3-[1-(phenylmethyl)imidazol-2-yl]propanoic acid

Systemtic Name: 3-[1-(phenylmethyl)imidazol-2-yl]propanoic acid Openeye Name: 3-(1-benzylimidazol-2-yl)propanoic acid CAS Name: 3-[1-(phenylmethyl)-2-imidazolyl]propanoic acid IUPAC Name: 3-(1-benzylimidazol-2-yl)propanoic acid Traditional Name: 3-(1-benzylimidazol-2-yl)propionic acid Formula: C13H14N2O2 MolecularWeight: 230.26246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2CCC(=O)O

InChI

InChI=1S/C13H14N2O2/c16-13(17)7-6-12-14-8-9-15(12)10-11-4-2-1-3-5-11/h1-5,8-9H,6-7,10H2,(H,16,17)