(7Z)-1,2-dimethyl-7-[(4-phenyldiazenylphenyl)hydrazinylidene]indazol-2-ium-6-one ethanoate

Systemtic Name: (7Z)-1,2-dimethyl-7-[(4-phenyldiazenylphenyl)hydrazinylidene]indazol-2-ium-6-one ethanoate Openeye Name: (7Z)-1,2-dimethyl-7-[(4-phenylazophenyl)hydrazono]indazol-2-ium-6-one acetate CAS Name: (7Z)-1,2-dimethyl-7-[(4-phenyldiazenylphenyl)hydrazinylidene]-6-indazol-2-iumone acetate IUPAC Name: (7Z)-1,2-dimethyl-7-[(4-phenyldiazenylphenyl)hydrazinylidene]indazol-2-ium-6-one acetate Traditional Name: (7Z)-1,2-dimethyl-7-[(4-phenylazophenyl)hydrazono]indazol-2-ium-6-one acetate Formula: C23H22N6O3 MolecularWeight: 430.45918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CN1C2=C(C=CC(=O)C2=NNC3=CC=C(C=C3)N=NC4=CC=CC=C4)C=[N+]1C

Isomeric SMILES

CC(=O)[O-].CN1C\2=C(C=CC(=O)/C2=N\NC3=CC=C(C=C3)N=NC4=CC=CC=C4)C=[N+]1C

InChI

InChI=1S/C21H18N6O.C2H4O2/c1-26-14-15-8-13-19(28)20(21(15)27(26)2)25-24-18-11-9-17(10-12-18)23-22-16-6-4-3-5-7-16;1-2(3)4/h3-14H,1-2H3;1H3,(H,3,4)