N-(1-butyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)-3,4,5-triethoxy-benzamide

Systemtic Name: N-(1-butyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)-3,4,5-triethoxy-benzamide Openeye Name: N-(1-butyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)-3,4,5-triethoxy-benzamide CAS Name: N-(1-butyl-6-methyl-3-pyrazolo[3,4-b]quinolinyl)-3,4,5-triethoxybenzamide IUPAC Name: N-(1-butyl-6-methylpyrazolo[3,4-b]quinolin-3-yl)-3,4,5-triethoxybenzamide Traditional Name: N-(1-butyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)-3,4,5-triethoxy-benzamide Formula: C28H34N4O4 MolecularWeight: 490.59396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N4O4/c1-6-10-13-32-27-21(15-19-14-18(5)11-12-22(19)29-27)26(31-32)30-28(33)20-16-23(34-7-2)25(36-9-4)24(17-20)35-8-3/h11-12,14-17H,6-10,13H2,1-5H3,(H,30,31,33)