2-[4-methyl-5-(phenylmethyl)imidazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-methyl-5-(phenylmethyl)imidazol-1-yl]ethanoic acid Openeye Name: 2-(5-benzyl-4-methyl-imidazol-1-yl)acetic acid CAS Name: 2-[4-methyl-5-(phenylmethyl)-1-imidazolyl]acetic acid IUPAC Name: 2-(5-benzyl-4-methylimidazol-1-yl)acetic acid Traditional Name: 2-(5-benzyl-4-methyl-imidazol-1-yl)acetic acid Formula: C13H14N2O2 MolecularWeight: 230.26246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=N1)CC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(N(C=N1)CC(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2/c1-10-12(7-11-5-3-2-4-6-11)15(9-14-10)8-13(16)17/h2-6,9H,7-8H2,1H3,(H,16,17)