2-[4-(2-imidazol-1-yl-2-oxidanylidene-ethyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-imidazol-1-yl-2-oxidanylidene-ethyl)phenyl]ethanoic acid Openeye Name: 2-[4-(2-imidazol-1-yl-2-oxo-ethyl)phenyl]acetic acid CAS Name: 2-[4-[2-(1-imidazolyl)-2-oxoethyl]phenyl]acetic acid IUPAC Name: 2-[4-(2-imidazol-1-yl-2-oxoethyl)phenyl]acetic acid Traditional Name: 2-[4-(2-imidazol-1-yl-2-keto-ethyl)phenyl]acetic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)N2C=CN=C2)CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC(=O)N2C=CN=C2)CC(=O)O

InChI

InChI=1S/C13H12N2O3/c16-12(15-6-5-14-9-15)7-10-1-3-11(4-2-10)8-13(17)18/h1-6,9H,7-8H2,(H,17,18)