[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C17H16FNO4 MolecularWeight: 317.311643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H16FNO4/c1-11(20)13-9-15(19-10-13)17(22)23-8-2-3-16(21)12-4-6-14(18)7-5-12/h4-7,9-10,19H,2-3,8H2,1H3