6-azanyl-1-(4-chlorophenyl)-4-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 6-azanyl-1-(4-chlorophenyl)-4-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 6-amino-1-(4-chlorophenyl)-4-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 6-amino-1-(4-chlorophenyl)-4-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 6-amino-1-(4-chlorophenyl)-4-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 6-amino-1-(4-chlorophenyl)-4-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C21H16ClN5O2 MolecularWeight: 405.83704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C3C=CC(=O)C(=C3)OC)C(=C(N=C2N(N1)C4=CC=C(C=C4)Cl)N)C#N

Isomeric SMILES

CC1=C2C(=C3C=CC(=O)C(=C3)OC)C(=C(N=C2N(N1)C4=CC=C(C=C4)Cl)N)C#N

InChI

InChI=1S/C21H16ClN5O2/c1-11-18-19(12-3-8-16(28)17(9-12)29-2)15(10-23)20(24)25-21(18)27(26-11)14-6-4-13(22)5-7-14/h3-9,26H,24H2,1-2H3