N-(1-butyl-6-methoxy-pyrazolo[3,4-b]quinolin-3-yl)benzamide

Systemtic Name: N-(1-butyl-6-methoxy-pyrazolo[3,4-b]quinolin-3-yl)benzamide Openeye Name: N-(1-butyl-6-methoxy-pyrazolo[3,4-b]quinolin-3-yl)benzamide CAS Name: N-(1-butyl-6-methoxy-3-pyrazolo[3,4-b]quinolinyl)benzamide IUPAC Name: N-(1-butyl-6-methoxypyrazolo[3,4-b]quinolin-3-yl)benzamide Traditional Name: N-(1-butyl-6-methoxy-pyrazolo[3,4-b]quinolin-3-yl)benzamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C3C=C(C=CC3=N2)OC)C(=N1)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=C(C=C3C=C(C=CC3=N2)OC)C(=N1)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2/c1-3-4-12-26-21-18(14-16-13-17(28-2)10-11-19(16)23-21)20(25-26)24-22(27)15-8-6-5-7-9-15/h5-11,13-14H,3-4,12H2,1-2H3,(H,24,25,27)