propan-2-yl 4-acetamido-3-(bromomethyl)benzoate

Systemtic Name: propan-2-yl 4-acetamido-3-(bromomethyl)benzoate Openeye Name: isopropyl 4-acetamido-3-(bromomethyl)benzoate CAS Name: 4-acetamido-3-(bromomethyl)benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-acetamido-3-(bromomethyl)benzoate Traditional Name: 4-acetamido-3-(bromomethyl)benzoic acid isopropyl ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=C(C=C1)NC(=O)C)CBr

Isomeric SMILES

CC(C)OC(=O)C1=CC(=C(C=C1)NC(=O)C)CBr

InChI

InChI=1S/C13H16BrNO3/c1-8(2)18-13(17)10-4-5-12(15-9(3)16)11(6-10)7-14/h4-6,8H,7H2,1-3H3,(H,15,16)