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

Systemtic Name: ethyl 3-[(4-fluorophenyl)carbonylamino]-4-(4-methoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-3-[(4-fluorobenzoyl)amino]-4-(4-methoxyphenyl)pyrrole-2-carboxylate CAS Name: 3-[[(4-fluorophenyl)-oxomethyl]amino]-4-(4-methoxyphenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-[(4-fluorobenzoyl)amino]-4-(4-methoxyphenyl)pyrrole-2-carboxylate Traditional Name: 1-benzyl-3-[(4-fluorobenzoyl)amino]-4-(4-methoxyphenyl)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=C(C=C3)OC)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

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