2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]propanoic acid

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]propanoic acid Openeye Name: 2-[(4-bromo-2-methyl-benzoyl)amino]propanoic acid CAS Name: 2-[[(4-bromo-2-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(4-bromo-2-methylbenzoyl)amino]propanoic acid Traditional Name: 2-[(4-bromo-2-methyl-benzoyl)amino]propionic acid Formula: C11H12BrNO3 MolecularWeight: 286.12188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C(=O)NC(C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C(=O)NC(C)C(=O)O

InChI

InChI=1S/C11H12BrNO3/c1-6-5-8(12)3-4-9(6)10(14)13-7(2)11(15)16/h3-5,7H,1-2H3,(H,13,14)(H,15,16)