4-[(3-bromanyl-4-methoxy-phenyl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(3-bromanyl-4-methoxy-phenyl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(3-bromo-4-methoxy-benzoyl)-methyl-amino]butanoic acid CAS Name: 4-[[(3-bromo-4-methoxyphenyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(3-bromo-4-methoxybenzoyl)-methylamino]butanoic acid Traditional Name: 4-[(3-bromo-4-methoxy-benzoyl)-methyl-amino]butyric acid Formula: C13H16BrNO4 MolecularWeight: 330.17444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C13H16BrNO4/c1-15(7-3-4-12(16)17)13(18)9-5-6-11(19-2)10(14)8-9/h5-6,8H,3-4,7H2,1-2H3,(H,16,17)