(3E)-3-(5-ethyl-6-methyl-benzimidazol-2-ylidene)-1,2-dihydroindazole-5-carboxylic acid

Systemtic Name: (3E)-3-(5-ethyl-6-methyl-benzimidazol-2-ylidene)-1,2-dihydroindazole-5-carboxylic acid Openeye Name: (3E)-3-(5-ethyl-6-methyl-benzimidazol-2-ylidene)-1,2-dihydroindazole-5-carboxylic acid CAS Name: (3E)-3-(5-ethyl-6-methyl-2-benzimidazolylidene)-1,2-dihydroindazole-5-carboxylic acid IUPAC Name: (3E)-3-(5-ethyl-6-methylbenzimidazol-2-ylidene)-1,2-dihydroindazole-5-carboxylic acid Traditional Name: (3E)-3-(5-ethyl-6-methyl-benzimidazol-2-ylidene)indazoline-5-carboxylic acid Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=NC(=C3C4=C(C=CC(=C4)C(=O)O)NN3)N=C2C=C1C

Isomeric SMILES

CCC1=CC2=N/C(=C/3\C4=C(C=CC(=C4)C(=O)O)NN3)/N=C2C=C1C

InChI

InChI=1S/C18H16N4O2/c1-3-10-8-15-14(6-9(10)2)19-17(20-15)16-12-7-11(18(23)24)4-5-13(12)21-22-16/h4-8,21-22H,3H2,1-2H3,(H,23,24)/b17-16+