(1-bromanyl-2-methyl-3-phenylazanyl-propan-2-yl) benzoate

Systemtic Name: (1-bromanyl-2-methyl-3-phenylazanyl-propan-2-yl) benzoate Openeye Name: [1-(anilinomethyl)-2-bromo-1-methyl-ethyl] benzoate CAS Name: benzoic acid (1-anilino-3-bromo-2-methylpropan-2-yl) ester IUPAC Name: (1-anilino-3-bromo-2-methylpropan-2-yl) benzoate Traditional Name: benzoic acid [1-(anilinomethyl)-2-bromo-1-methyl-ethyl] ester Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=CC=C1)(CBr)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CNC1=CC=CC=C1)(CBr)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18BrNO2/c1-17(12-18,13-19-15-10-6-3-7-11-15)21-16(20)14-8-4-2-5-9-14/h2-11,19H,12-13H2,1H3