[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-cyano-2-fluoranyl-benzoate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-cyano-2-fluoranyl-benzoate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 4-cyano-2-fluoro-benzoate CAS Name: 4-cyano-2-fluorobenzoic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 4-cyano-2-fluorobenzoate Traditional Name: 4-cyano-2-fluoro-benzoic acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C18H15FN2O3 MolecularWeight: 326.321703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15FN2O3/c1-11-4-3-5-16(12(11)2)21-17(22)10-24-18(23)14-7-6-13(9-20)8-15(14)19/h3-8H,10H2,1-2H3,(H,21,22)