[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate CAS Name: 2-[4-(trifluoromethyl)phenyl]benzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-[4-(trifluoromethyl)phenyl]benzoate Traditional Name: 2-[4-(trifluoromethyl)phenyl]benzoic acid [2-keto-2-(4-phenylpiperazino)ethyl] ester Formula: C26H23F3N2O3 MolecularWeight: 468.46763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C26H23F3N2O3/c27-26(28,29)20-12-10-19(11-13-20)22-8-4-5-9-23(22)25(33)34-18-24(32)31-16-14-30(15-17-31)21-6-2-1-3-7-21/h1-13H,14-18H2