6-azanyl-4-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile

Systemtic Name: 6-azanyl-4-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Openeye Name: 6-amino-4-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile CAS Name: 6-amino-4-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-3-methyl-1-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile IUPAC Name: 6-amino-4-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Traditional Name: 6-amino-4-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Formula: C21H18N5O2+ MolecularWeight: 372.39992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C3C=CC(=O)C(=C3)OC)C(=C(NC2=[N+](N1)C4=CC=CC=C4)N)C#N

Isomeric SMILES

CC1=C2C(=C3C=CC(=O)C(=C3)OC)C(=C(NC2=[N+](N1)C4=CC=CC=C4)N)C#N

InChI

InChI=1S/C21H17N5O2/c1-12-18-19(13-8-9-16(27)17(10-13)28-2)15(11-22)20(23)24-21(18)26(25-12)14-6-4-3-5-7-14/h3-10H,1-2H3,(H3,23,24,25,27)/p+1