2-[(6Z)-6-(2-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-dihydroindazol-3-yl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[(6Z)-6-(2-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-dihydroindazol-3-yl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[(6Z)-6-(2-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1,2-dihydroindazol-3-yl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[(6Z)-6-(2-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1,2-dihydroindazol-3-yl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[(6Z)-6-(2-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydroindazol-3-yl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[(6Z)-6-(4-keto-2-methoxy-cyclohexa-2,5-dien-1-ylidene)-1,2-dihydroindazol-3-yl]-3H-benzimidazole-5-carboxylic acid Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C=CC1=C2C=CC3=C(NNC3=C2)C4=NC5=C(N4)C=C(C=C5)C(=O)O

Isomeric SMILES

COC\1=CC(=O)C=C/C1=C/2\C=CC3=C(NNC3=C2)C4=NC5=C(N4)C=C(C=C5)C(=O)O

InChI

InChI=1S/C22H16N4O4/c1-30-19-10-13(27)4-6-14(19)11-2-5-15-17(8-11)25-26-20(15)21-23-16-7-3-12(22(28)29)9-18(16)24-21/h2-10,25-26H,1H3,(H,23,24)(H,28,29)/b14-11-