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5-Chloro-3-[3-(4-cyclohexylpiperazino)propanoylamino]-1H-indole-2-carboxylic acid methyl ester
SpectraBase Compound ID 3GnzqixX18s
InChI InChI=1S/C23H31ClN4O3/c1-31-23(30)22-21(18-15-16(24)7-8-19(18)25-22)26-20(29)9-10-27-11-13-28(14-12-27)17-5-3-2-4-6-17/h7-8,15,17,25H,2-6,9-14H2,1H3,(H,26,29)
InChIKey FDZVUOCOEGXCBN-UHFFFAOYSA-N
Mol Weight 446.98 g/mol
Molecular Formula C23H31ClN4O3
Exact Mass 446.208469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UYC9wEabzu
Name 5-Chloro-3-[3-(4-cyclohexylpiperazino)propanoylamino]-1H-indole-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31ClN4O3
InChI InChI=1S/C23H31ClN4O3/c1-31-23(30)22-21(18-15-16(24)7-8-19(18)25-22)26-20(29)9-10-27-11-13-28(14-12-27)17-5-3-2-4-6-17/h7-8,15,17,25H,2-6,9-14H2,1H3,(H,26,29)
InChIKey FDZVUOCOEGXCBN-UHFFFAOYSA-N
Molecular Weight 446.979 g/mol
SMILES [nH]1c2ccc(cc2c(c1C(=O)OC)NC(CCN1CCN(CC1)C1CCCCC1)=O)Cl
SPLASH splash10-0a4l-8920000000-73ed98b6baece44daa1a
Synonyms 5-Chloro-3-[[3-(4-cyclohexyl-1-piperazinyl)-1-oxopropyl]amino]-1H-indole-2-carboxylic acid methyl ester Methyl 5-chloranyl-3-[3-(4-cyclohexylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate Methyl 5-chloro-3-[3-(4-cyclohexylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate
Wiley ID 1445499