[2-[[2-[(4-fluorophenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [2-[[2-[(4-fluorophenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-oxo-ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-[2-[(4-fluoroanilino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-oxoethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-keto-ethyl] ester Formula: C20H16FN3O4 MolecularWeight: 381.357143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)F)NC(=O)COC(=O)C3=CC=CN3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)F)NC(=O)COC(=O)C3=CC=CN3

InChI

InChI=1S/C20H16FN3O4/c21-13-7-9-14(10-8-13)23-19(26)15-4-1-2-5-16(15)24-18(25)12-28-20(27)17-6-3-11-22-17/h1-11,22H,12H2,(H,23,26)(H,24,25)