methyl 6-methoxy-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 6-methoxy-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-6-methoxy-1H-indole-2-carboxylate CAS Name: 6-methoxy-3-[[1-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-6-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-(4-benzylpiperazino)acetyl]amino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C24H28N4O4 MolecularWeight: 436.50352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O4/c1-31-18-8-9-19-20(14-18)25-23(24(30)32-2)22(19)26-21(29)16-28-12-10-27(11-13-28)15-17-6-4-3-5-7-17/h3-9,14,25H,10-13,15-16H2,1-2H3,(H,26,29)