[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-4-fluoranyl-benzoate

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-4-fluoranyl-benzoate Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl] 2-chloro-4-fluoro-benzoate CAS Name: 2-chloro-4-fluorobenzoic acid [2-(2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl] 2-chloro-4-fluorobenzoate Traditional Name: 2-chloro-4-fluoro-benzoic acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester Formula: C17H15ClFNO3 MolecularWeight: 335.757303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)C2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)C2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C17H15ClFNO3/c1-10-4-3-5-11(2)16(10)20-15(21)9-23-17(22)13-7-6-12(19)8-14(13)18/h3-8H,9H2,1-2H3,(H,20,21)