(2-chloranyl-6-fluoranyl-phenyl)methyl 4-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 4-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 4-(3,5-dimethylanilino)-4-oxo-butanoate CAS Name: 4-(3,5-dimethylanilino)-4-oxobutanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 4-(3,5-dimethylanilino)-4-oxobutanoate Traditional Name: 4-(3,5-dimethylanilino)-4-keto-butyric acid (2-chloro-6-fluoro-benzyl) ester Formula: C19H19ClFNO3 MolecularWeight: 363.810463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CCC(=O)OCC2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CCC(=O)OCC2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C19H19ClFNO3/c1-12-8-13(2)10-14(9-12)22-18(23)6-7-19(24)25-11-15-16(20)4-3-5-17(15)21/h3-5,8-10H,6-7,11H2,1-2H3,(H,22,23)