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

Systemtic Name: ethyl 4-[[4-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-[[5-(3-methoxyphenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[5-(3-methoxyphenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C33H34N4O5 MolecularWeight: 566.64686

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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)OC)C5=CC=CC=C5)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)OC)C5=CC=CC=C5)C

InChI

InChI=1S/C33H34N4O5/c1-4-42-32(39)24-13-15-26(16-14-24)34-33(40)36-19-17-35(18-20-36)31(38)29-22-30(25-9-8-12-28(21-25)41-3)37(23(29)2)27-10-6-5-7-11-27/h5-16,21-22H,4,17-20H2,1-3H3,(H,34,40)