[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl] 3-fluoranylbenzoate

Systemtic Name: [2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl] 3-fluoranylbenzoate Openeye Name: [2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethyl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethyl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethyl] ester Formula: C20H20ClFN2O3 MolecularWeight: 390.835803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC(=O)C3=CC(=CC=C3)F

InChI

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