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

Systemtic Name: ethyl 4-(3-fluorophenyl)-3-[(2-methoxyphenyl)carbonylamino]-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-4-(3-fluorophenyl)-3-[(2-methoxybenzoyl)amino]pyrrole-2-carboxylate CAS Name: 4-(3-fluorophenyl)-3-[[(2-methoxyphenyl)-oxomethyl]amino]-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(3-fluorophenyl)-3-[(2-methoxybenzoyl)amino]pyrrole-2-carboxylate Traditional Name: 1-benzyl-4-(3-fluorophenyl)-3-(o-anisoylamino)pyrrole-2-carboxylic acid ethyl ester Formula: C28H25FN2O4 MolecularWeight: 472.507503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=CC=C3)F)NC(=O)C4=CC=CC=C4OC

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=CC=C3)F)NC(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C28H25FN2O4/c1-3-35-28(33)26-25(30-27(32)22-14-7-8-15-24(22)34-2)23(20-12-9-13-21(29)16-20)18-31(26)17-19-10-5-4-6-11-19/h4-16,18H,3,17H2,1-2H3,(H,30,32)