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6-Bromanyl-4-[(dimethylazaniumyl)methyl]-3-ethoxycarbonyl-1-methyl-2-(piperidin-1-ylmethyl)indol-5-olate
SpectraBase Compound ID KQ69YXqNHID
InChI InChI=1S/C21H30BrN3O3/c1-5-28-21(27)19-17(13-25-9-7-6-8-10-25)24(4)16-11-15(22)20(26)14(18(16)19)12-23(2)3/h11,26H,5-10,12-13H2,1-4H3
InChIKey SNIICYHOLRUPII-UHFFFAOYSA-N
Mol Weight 452.39 g/mol
Molecular Formula C21H30BrN3O3
Exact Mass 451.147055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27TjRXUuK1s
Name 6-Bromanyl-4-[(dimethylazaniumyl)methyl]-3-ethoxycarbonyl-1-methyl-2-(piperidin-1-ylmethyl)indol-5-olate
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Formula C21H30BrN3O3
InChI InChI=1S/C21H30BrN3O3/c1-5-28-21(27)19-17(13-25-9-7-6-8-10-25)24(4)16-11-15(22)20(26)14(18(16)19)12-23(2)3/h11,26H,5-10,12-13H2,1-4H3
InChIKey SNIICYHOLRUPII-UHFFFAOYSA-N
Molecular Weight 452.393 g/mol
SMILES Oc1c(c2c(c([n](C)c2cc1Br)CN1CCCCC1)C(=O)OCC)CN(C)C
SPLASH splash10-001l-5159000000-e016877b9925c5c4aaa2
Synonyms 6-Bromo-3-carbethoxy-4-[(dimethylammonio)methyl]-1-methyl-2-(piperidinomethyl)indol-5-olate 6-Bromo-4-[(dimethylammonio)methyl]-3-ethoxycarbonyl-1-methyl-2-(1-piperidinylmethyl)-5-indololate 6-Bromo-4-[(dimethylammonio)methyl]-3-ethoxycarbonyl-1-methyl-2-(1-piperidylmethyl)indol-5-olate 6-Bromo-4-[(dimethylazaniumyl)methyl]-3-ethoxycarbonyl-1-methyl-2-(piperidin-1-ylmethyl)indol-5-olate Ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-methyl-2-(piperidin-1-ylmethyl)indole-3-carboxylate 6-Bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-(1-piperidinylmethyl)-3-indolecarboxylic acid ethyl ester Ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-(piperidin-1-ylmethyl)indole-3-carboxylate Ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-(1-piperidylmethyl)indole-3-carboxylate Ethyl 6-bromanyl-4-[(dimethylamino)methyl]-1-methyl-5-oxidanyl-2-(piperidin-1-ylmethyl)indole-3-carboxylate
Wiley ID 1436624