ethyl 4-[[4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-[[1-(2-chlorophenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[1-(2-chlorophenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C32H31ClN4O4 MolecularWeight: 571.06594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC=CC=C4)C5=CC=CC=C5Cl)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC=CC=C4)C5=CC=CC=C5Cl)C

InChI

InChI=1S/C32H31ClN4O4/c1-3-41-31(39)24-13-15-25(16-14-24)34-32(40)36-19-17-35(18-20-36)30(38)26-21-29(23-9-5-4-6-10-23)37(22(26)2)28-12-8-7-11-27(28)33/h4-16,21H,3,17-20H2,1-2H3,(H,34,40)