3-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-1,2-dihydroindazol-6-yl]carbonylimino]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 3-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-1,2-dihydroindazol-6-yl]carbonylimino]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 3-[3-(1,3-dihydrobenzimidazol-2-ylidene)-1,2-dihydroindazole-6-carbonyl]imino-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 3-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-1,2-dihydroindazol-6-yl]-oxomethyl]imino-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 3-[3-(1,3-dihydrobenzimidazol-2-ylidene)-1,2-dihydroindazole-6-carbonyl]imino-6-oxocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 3-[3-(1,3-dihydrobenzimidazol-2-ylidene)indazoline-6-carbonyl]imino-6-keto-cyclohexa-1,4-diene-1-carboxylic acid Formula: C22H15N5O4 MolecularWeight: 413.3856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C4=C(C=C(C=C4)C(=O)N=C5C=CC(=O)C(=C5)C(=O)O)NN3)N2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C3C4=C(C=C(C=C4)C(=O)N=C5C=CC(=O)C(=C5)C(=O)O)NN3)N2

InChI

InChI=1S/C22H15N5O4/c28-18-8-6-12(10-14(18)22(30)31)23-21(29)11-5-7-13-17(9-11)26-27-19(13)20-24-15-3-1-2-4-16(15)25-20/h1-10,24-27H,(H,30,31)