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

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-3-[(4-methylphenyl)carbonylamino]-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-[(4-methylbenzoyl)amino]pyrrole-2-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-3-[[(4-methylphenyl)-oxomethyl]amino]-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-[(4-methylbenzoyl)amino]pyrrole-2-carboxylate Traditional Name: 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(p-toluoylamino)pyrrole-2-carboxylic acid ethyl ester Formula: C30H30N2O5 MolecularWeight: 498.5696

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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)OC)NC(=O)C4=CC=C(C=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C30H30N2O5/c1-5-37-30(34)28-27(31-29(33)22-13-11-20(2)12-14-22)24(19-32(28)18-21-9-7-6-8-10-21)23-15-16-25(35-3)26(17-23)36-4/h6-17,19H,5,18H2,1-4H3,(H,31,33)