[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-fluoranyl-benzoate

Systemtic Name: [2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-fluoranyl-benzoate Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-ethyl] 2-bromo-5-fluoro-benzoate CAS Name: 2-bromo-5-fluorobenzoic acid [2-(2,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylanilino)-2-oxoethyl] 2-bromo-5-fluorobenzoate Traditional Name: 2-bromo-5-fluoro-benzoic acid [2-(2,5-dimethylanilino)-2-keto-ethyl] ester Formula: C17H15BrFNO3 MolecularWeight: 380.208303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrFNO3/c1-10-3-4-11(2)15(7-10)20-16(21)9-23-17(22)13-8-12(19)5-6-14(13)18/h3-8H,9H2,1-2H3,(H,20,21)