(E)-3-[3-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid hydrochloride

Systemtic Name: (E)-3-[3-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid hydrochloride Openeye Name: (E)-3-[3-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid hydrochloride CAS Name: (E)-3-[3-(1-imidazolylmethyl)phenyl]-2-propenoic acid hydrochloride IUPAC Name: (E)-3-[3-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid hydrochloride Traditional Name: (E)-3-[3-(imidazol-1-ylmethyl)phenyl]acrylic acid hydrochloride Formula: C13H13ClN2O2 MolecularWeight: 264.70752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=CN=C2)C=CC(=O)O.Cl

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=CN=C2)/C=C/C(=O)O.Cl

InChI

InChI=1S/C13H12N2O2.ClH/c16-13(17)5-4-11-2-1-3-12(8-11)9-15-7-6-14-10-15;/h1-8,10H,9H2,(H,16,17);1H/b5-4+;