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6-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid isopropyl ester
SpectraBase Compound ID 3UNYFsSWuE0
InChI InChI=1S/C22H27ClN2O3/c1-13(2)28-22(27)18-8-5-4-7-17(18)21(26)24-12-11-15-14(3)25-20-16(15)9-6-10-19(20)23/h4-6,9-10,13,17-18,25H,7-8,11-12H2,1-3H3,(H,24,26)
InChIKey UPFMWZWQPMHRBE-UHFFFAOYSA-N
Mol Weight 402.92 g/mol
Molecular Formula C22H27ClN2O3
Exact Mass 402.17102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gNqscICSdF
Name 6-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid isopropyl ester
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Formula C22H27ClN2O3
InChI InChI=1S/C22H27ClN2O3/c1-13(2)28-22(27)18-8-5-4-7-17(18)21(26)24-12-11-15-14(3)25-20-16(15)9-6-10-19(20)23/h4-6,9-10,13,17-18,25H,7-8,11-12H2,1-3H3,(H,24,26)
InChIKey UPFMWZWQPMHRBE-UHFFFAOYSA-N
Molecular Weight 402.922 g/mol
SMILES N(C(=O)C1C(CC=CC1)C(OC(C)C)=O)CCc1c([nH]c2c1cccc2Cl)C
SPLASH splash10-0006-3900000000-6081a7979aee04b11b6e
Synonyms 6-[[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylamino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid propan-2-yl ester isopropyl 6-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Propan-2-yl 6-[2-(7-chloranyl-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Propan-2-yl 6-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate
Wiley ID 1445418