3-[(2Z)-2-[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]imidazol-2-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 3-[(2Z)-2-[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]imidazol-2-ylidene]hydrazinyl]benzoic acid Openeye Name: 3-[(2Z)-2-[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]imidazol-2-ylidene]hydrazino]benzoic acid CAS Name: 3-[(2Z)-2-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2-imidazolylidene]hydrazinyl]benzoic acid IUPAC Name: 3-[(2Z)-2-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]imidazol-2-ylidene]hydrazinyl]benzoic acid Traditional Name: 3-[(N'Z)-N'-[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]imidazol-2-ylidene]hydrazino]benzoic acid Formula: C13H10N4O4 MolecularWeight: 286.2429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NN=C2N=CC(=N2)C=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N/N=C\2/N=CC(=N2)/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C13H10N4O4/c18-11(19)5-4-10-7-14-13(15-10)17-16-9-3-1-2-8(6-9)12(20)21/h1-7,16H,(H,18,19)(H,20,21)/b5-4+,17-13-