ethyl 3-benzamido-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3-benzamido-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 3-benzamido-1-benzyl-4-(3,4-dimethoxyphenyl)pyrrole-2-carboxylate CAS Name: 3-benzamido-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzamido-1-benzyl-4-(3,4-dimethoxyphenyl)pyrrole-2-carboxylate Traditional Name: 3-benzamido-1-benzyl-4-(3,4-dimethoxyphenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C29H28N2O5 MolecularWeight: 484.54302

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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

Isomeric SMILES

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

InChI

InChI=1S/C29H28N2O5/c1-4-36-29(33)27-26(30-28(32)21-13-9-6-10-14-21)23(19-31(27)18-20-11-7-5-8-12-20)22-15-16-24(34-2)25(17-22)35-3/h5-17,19H,4,18H2,1-3H3,(H,30,32)