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

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-3-[(3-methylphenyl)carbonylamino]-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-[(3-methylbenzoyl)amino]pyrrole-2-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-3-[[(3-methylphenyl)-oxomethyl]amino]-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-[(3-methylbenzoyl)amino]pyrrole-2-carboxylate Traditional Name: 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(m-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(=CC=C4)C

Isomeric SMILES

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

InChI

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