[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 2-chloranyl-4-fluoranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 2-chloranyl-4-fluoranyl-benzoate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 2-chloro-4-fluoro-benzoate CAS Name: 2-chloro-4-fluorobenzoic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 2-chloro-4-fluorobenzoate Traditional Name: 2-chloro-4-fluoro-benzoic acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C22H17ClFNO3 MolecularWeight: 397.826683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H17ClFNO3/c23-19-13-17(24)10-11-18(19)22(27)28-14-21(26)25-20-9-5-4-8-16(20)12-15-6-2-1-3-7-15/h1-11,13H,12,14H2,(H,25,26)