methyl 2-acetamido-3-[4-(bromomethyl)phenyl]propanoate

Systemtic Name: methyl 2-acetamido-3-[4-(bromomethyl)phenyl]propanoate Openeye Name: methyl 2-acetamido-3-[4-(bromomethyl)phenyl]propanoate CAS Name: 2-acetamido-3-[4-(bromomethyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-[4-(bromomethyl)phenyl]propanoate Traditional Name: 2-acetamido-3-[4-(bromomethyl)phenyl]propionic acid methyl ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)CBr)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)CBr)C(=O)OC

InChI

InChI=1S/C13H16BrNO3/c1-9(16)15-12(13(17)18-2)7-10-3-5-11(8-14)6-4-10/h3-6,12H,7-8H2,1-2H3,(H,15,16)