4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)piperazino]-4-keto-butyric acid Formula: C20H20ClFN2O3 MolecularWeight: 390.835803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClFN2O3/c21-15-3-1-14(2-4-15)19(25)13-18(20(26)27)24-11-9-23(10-12-24)17-7-5-16(22)6-8-17/h1-8,18H,9-13H2,(H,26,27)