butyl 3-[2-(3,4-dimethyl-6-oxidanylidene-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)ethanoylamino]benzoate

Systemtic Name: butyl 3-[2-(3,4-dimethyl-6-oxidanylidene-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)ethanoylamino]benzoate Openeye Name: butyl 3-[[2-(3,4-dimethyl-6-oxo-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(3,4-dimethyl-6-oxo-1-phenyl-7-pyrazolo[3,4-b]pyridinyl)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[2-(3,4-dimethyl-6-oxo-1-phenylpyrazolo[3,4-b]pyridin-7-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(6-keto-3,4-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)acetyl]amino]benzoic acid butyl ester Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C=C(C3=C2N(N=C3C)C4=CC=CC=C4)C

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C=C(C3=C2N(N=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H28N4O4/c1-4-5-14-35-27(34)20-10-9-11-21(16-20)28-23(32)17-30-24(33)15-18(2)25-19(3)29-31(26(25)30)22-12-7-6-8-13-22/h6-13,15-16H,4-5,14,17H2,1-3H3,(H,28,32)