[1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-bromanylbenzoate

Systemtic Name: [1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-bromanylbenzoate Openeye Name: [1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylanilino)-1-oxopropan-2-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C17H16BrNO3 MolecularWeight: 362.21784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C17H16BrNO3/c1-11-7-9-13(10-8-11)19-16(20)12(2)22-17(21)14-5-3-4-6-15(14)18/h3-10,12H,1-2H3,(H,19,20)