[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-bromanyl-2-fluoranyl-benzoate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-bromanyl-2-fluoranyl-benzoate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 4-bromo-2-fluoro-benzoate CAS Name: 4-bromo-2-fluorobenzoic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] 4-bromo-2-fluorobenzoate Traditional Name: 4-bromo-2-fluoro-benzoic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C17H15BrFNO3 MolecularWeight: 380.208303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(C=C(C=C2)Br)F

InChI

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