4-[2-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)imidazol-2-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)imidazol-2-ylidene]hydrazinyl]benzoic acid Openeye Name: 4-[2-[4-(2-amino-3-hydroxy-3-oxo-propyl)imidazol-2-ylidene]hydrazino]benzoic acid CAS Name: 4-[2-[4-(2-amino-3-hydroxy-3-oxopropyl)-2-imidazolylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[2-[4-(2-amino-3-hydroxy-3-oxopropyl)imidazol-2-ylidene]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[4-(2-amino-3-hydroxy-3-keto-propyl)imidazol-2-ylidene]hydrazino]benzoic acid Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NN=C2N=CC(=N2)CC(C(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NN=C2N=CC(=N2)CC(C(=O)O)N

InChI

InChI=1S/C13H13N5O4/c14-10(12(21)22)5-9-6-15-13(16-9)18-17-8-3-1-7(2-4-8)11(19)20/h1-4,6,10,17H,5,14H2,(H,19,20)(H,21,22)