ethyl 4-(4-methoxyphenyl)-3-[(3-methylphenyl)carbonylamino]-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-3-[(3-methylphenyl)carbonylamino]-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-4-(4-methoxyphenyl)-3-[(3-methylbenzoyl)amino]pyrrole-2-carboxylate CAS Name: 4-(4-methoxyphenyl)-3-[[(3-methylphenyl)-oxomethyl]amino]-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(4-methoxyphenyl)-3-[(3-methylbenzoyl)amino]pyrrole-2-carboxylate Traditional Name: 1-benzyl-4-(4-methoxyphenyl)-3-(m-toluoylamino)pyrrole-2-carboxylic acid ethyl ester Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC=C(C=C3)OC)NC(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC=C(C=C3)OC)NC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C29H28N2O4/c1-4-35-29(33)27-26(30-28(32)23-12-8-9-20(2)17-23)25(22-13-15-24(34-3)16-14-22)19-31(27)18-21-10-6-5-7-11-21/h5-17,19H,4,18H2,1-3H3,(H,30,32)