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

Systemtic Name: ethyl 3-benzamido-4-(3-fluorophenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 3-benzamido-1-benzyl-4-(3-fluorophenyl)pyrrole-2-carboxylate CAS Name: 3-benzamido-4-(3-fluorophenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzamido-1-benzyl-4-(3-fluorophenyl)pyrrole-2-carboxylate Traditional Name: 3-benzamido-1-benzyl-4-(3-fluorophenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C27H23FN2O3 MolecularWeight: 442.481523

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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=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H23FN2O3/c1-2-33-27(32)25-24(29-26(31)20-12-7-4-8-13-20)23(21-14-9-15-22(28)16-21)18-30(25)17-19-10-5-3-6-11-19/h3-16,18H,2,17H2,1H3,(H,29,31)