ethyl 3-[(2-acetyloxy-2-phenyl-ethanoyl)amino]-4-(3-fluorophenyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3-[(2-acetyloxy-2-phenyl-ethanoyl)amino]-4-(3-fluorophenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 3-[(2-acetoxy-2-phenyl-acetyl)amino]-1-benzyl-4-(3-fluorophenyl)pyrrole-2-carboxylate CAS Name: 3-[(2-acetyloxy-1-oxo-2-phenylethyl)amino]-4-(3-fluorophenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-acetyloxy-2-phenylacetyl)amino]-1-benzyl-4-(3-fluorophenyl)pyrrole-2-carboxylate Traditional Name: 3-[(2-acetoxy-2-phenyl-acetyl)amino]-1-benzyl-4-(3-fluorophenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C30H27FN2O5 MolecularWeight: 514.544183

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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)C(C4=CC=CC=C4)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C30H27FN2O5/c1-3-37-30(36)27-26(32-29(35)28(38-20(2)34)22-13-8-5-9-14-22)25(23-15-10-16-24(31)17-23)19-33(27)18-21-11-6-4-7-12-21/h4-17,19,28H,3,18H2,1-2H3,(H,32,35)