3-[4-(imidazol-1-ylmethyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(imidazol-1-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[4-(imidazol-1-ylmethyl)phenyl]propanoic acid CAS Name: 3-[4-(1-imidazolylmethyl)phenyl]propanoic acid IUPAC Name: 3-[4-(imidazol-1-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[4-(imidazol-1-ylmethyl)phenyl]propionic acid Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)CN2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)CN2C=CN=C2

InChI

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