methyl 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[4-(3-chlorophenyl)piperazin-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(3-chlorophenyl)piperazin-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-(3-chlorophenyl)piperazino]acetyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC(=CC=C4)Cl)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC(=CC=C4)Cl)C(=O)OC

InChI

InChI=1S/C23H25ClN4O3/c1-15-6-7-19-18(12-15)21(22(25-19)23(30)31-2)26-20(29)14-27-8-10-28(11-9-27)17-5-3-4-16(24)13-17/h3-7,12-13,25H,8-11,14H2,1-2H3,(H,26,29)