4-[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]imidazol-1-yl]benzoic acid

Systemtic Name: 4-[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]imidazol-1-yl]benzoic acid Openeye Name: 4-[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]imidazol-1-yl]benzoic acid CAS Name: 4-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-1-imidazolyl]benzoic acid IUPAC Name: 4-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]imidazol-1-yl]benzoic acid Traditional Name: 4-[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]imidazol-1-yl]benzoic acid Formula: C13H10N2O4 MolecularWeight: 258.2295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C=C(N=C2)C=CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C=C(N=C2)/C=C/C(=O)O

InChI

InChI=1S/C13H10N2O4/c16-12(17)6-3-10-7-15(8-14-10)11-4-1-9(2-5-11)13(18)19/h1-8H,(H,16,17)(H,18,19)/b6-3+