3-[3-(2-methylimidazol-1-yl)phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-(2-methylimidazol-1-yl)phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-(2-methylimidazol-1-yl)phenyl]-3-oxo-propanoic acid CAS Name: 3-[3-(2-methyl-1-imidazolyl)phenyl]-3-oxopropanoic acid IUPAC Name: 3-[3-(2-methylimidazol-1-yl)phenyl]-3-oxopropanoic acid Traditional Name: 3-keto-3-[3-(2-methylimidazol-1-yl)phenyl]propionic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=CC(=C2)C(=O)CC(=O)O

Isomeric SMILES

CC1=NC=CN1C2=CC=CC(=C2)C(=O)CC(=O)O

InChI

InChI=1S/C13H12N2O3/c1-9-14-5-6-15(9)11-4-2-3-10(7-11)12(16)8-13(17)18/h2-7H,8H2,1H3,(H,17,18)