[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-oxo-2-(p-tolylmethylamino)ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-[(4-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylphenyl)methylamino]-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-keto-2-[(4-methylbenzyl)amino]ethyl] ester Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO3/c1-12-2-4-13(5-3-12)10-19-16(20)11-22-17(21)14-6-8-15(18)9-7-14/h2-9H,10-11H2,1H3,(H,19,20)