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

Systemtic Name: (E)-3-[3-chloranyl-2-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-chloro-2-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-chloro-2-(1-imidazolylmethyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-chloro-2-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-chloro-2-(imidazol-1-ylmethyl)phenyl]acrylic acid Formula: C13H11ClN2O2 MolecularWeight: 262.69164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2O2/c14-12-3-1-2-10(4-5-13(17)18)11(12)8-16-7-6-15-9-16/h1-7,9H,8H2,(H,17,18)/b5-4+