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

Systemtic Name: methyl 3-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]ethanoylamino]-4-methoxy-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]acetyl]amino]-4-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-1-oxoethyl]amino]-4-methoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]acetyl]amino]-4-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]acetyl]amino]-4-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C30H31ClN4O4 MolecularWeight: 547.04454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C30H31ClN4O4/c1-38-24-10-6-9-23-26(24)27(28(32-23)30(37)39-2)33-25(36)19-34-15-17-35(18-16-34)29(20-7-4-3-5-8-20)21-11-13-22(31)14-12-21/h3-14,29,32H,15-19H2,1-2H3,(H,33,36)