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

Systemtic Name: ethyl 3-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]ethanoylamino]-5-methoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]acetyl]amino]-5-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-1-oxoethyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]acetyl]amino]-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]acetyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C31H33ClN4O4 MolecularWeight: 561.07112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C31H33ClN4O4/c1-3-40-31(38)29-28(25-19-24(39-2)13-14-26(25)33-29)34-27(37)20-35-15-17-36(18-16-35)30(21-7-5-4-6-8-21)22-9-11-23(32)12-10-22/h4-14,19,30,33H,3,15-18,20H2,1-2H3,(H,34,37)