2-azanyl-3-[4-(bromomethyl)phenyl]-2-methyl-3-oxidanylidene-propanoic acid

Systemtic Name: 2-azanyl-3-[4-(bromomethyl)phenyl]-2-methyl-3-oxidanylidene-propanoic acid Openeye Name: 2-amino-3-[4-(bromomethyl)phenyl]-2-methyl-3-oxo-propanoic acid CAS Name: 2-amino-3-[4-(bromomethyl)phenyl]-2-methyl-3-oxopropanoic acid IUPAC Name: 2-amino-3-[4-(bromomethyl)phenyl]-2-methyl-3-oxopropanoic acid Traditional Name: 2-amino-3-[4-(bromomethyl)phenyl]-3-keto-2-methyl-propionic acid Formula: C11H12BrNO3 MolecularWeight: 286.12188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)CBr)(C(=O)O)N

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)CBr)(C(=O)O)N

InChI

InChI=1S/C11H12BrNO3/c1-11(13,10(15)16)9(14)8-4-2-7(6-12)3-5-8/h2-5H,6,13H2,1H3,(H,15,16)