[(2S)-1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenoxybenzoate

Systemtic Name: [(2S)-1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenoxybenzoate Openeye Name: [(1S)-2-(4-chloroanilino)-1-methyl-2-oxo-ethyl] 3-phenoxybenzoate CAS Name: 3-phenoxybenzoic acid [(2S)-1-(4-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-chloroanilino)-1-oxopropan-2-yl] 3-phenoxybenzoate Traditional Name: 3-phenoxybenzoic acid [(1S)-2-(4-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H18ClNO4 MolecularWeight: 395.83562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)Cl)OC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H18ClNO4/c1-15(21(25)24-18-12-10-17(23)11-13-18)27-22(26)16-6-5-9-20(14-16)28-19-7-3-2-4-8-19/h2-15H,1H3,(H,24,25)/t15-/m0/s1