4-(4-chlorophenyl)-3-methyl-1-(4-nitrophenyl)carbonyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-3-methyl-1-(4-nitrophenyl)carbonyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-3-methyl-1-(4-nitrobenzoyl)-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-3-methyl-1-[(4-nitrophenyl)-oxomethyl]-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 4-(4-chlorophenyl)-3-methyl-1-(4-nitrobenzoyl)-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-6-keto-3-methyl-1-(4-nitrobenzoyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C21H14ClN5O4 MolecularWeight: 435.81996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(C(=O)N=C2N(N1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C2C(C(C(=O)N=C2N(N1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN5O4/c1-11-17-18(12-2-6-14(22)7-3-12)16(10-23)20(28)24-19(17)26(25-11)21(29)13-4-8-15(9-5-13)27(30)31/h2-9,16,18,25H,1H3