4-[4-[4-(4-fluorophenyl)carbonylphenyl]piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[4-(4-fluorophenyl)carbonylphenyl]piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[4-(4-fluorobenzoyl)phenyl]piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-[4-[(4-fluorophenyl)-oxomethyl]phenyl]-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[4-(4-fluorobenzoyl)phenyl]piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-[4-(4-fluorobenzoyl)phenyl]piperazino]-4-keto-butyric acid Formula: C21H21FN2O4 MolecularWeight: 384.400843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F)C(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F)C(=O)CCC(=O)O

InChI

InChI=1S/C21H21FN2O4/c22-17-5-1-15(2-6-17)21(28)16-3-7-18(8-4-16)23-11-13-24(14-12-23)19(25)9-10-20(26)27/h1-8H,9-14H2,(H,26,27)