[1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-methylbenzoate

Systemtic Name: [1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-methylbenzoate Openeye Name: [2-(4-bromoanilino)-1-methyl-2-oxo-ethyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [1-(4-bromoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromoanilino)-1-oxopropan-2-yl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-(4-bromoanilino)-2-keto-1-methyl-ethyl] ester Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)Br

InChI

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