4-[[6-methyl-1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-methyl-1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(1-isobutyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[[6-methyl-1-(2-methylpropyl)-3-pyrazolo[3,4-b]quinolinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-methyl-1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[(1-isobutyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-keto-butyric acid Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC3=C(N=C2C=C1)N(N=C3NC(=O)CCC(=O)O)CC(C)C

Isomeric SMILES

CC1=CC2=CC3=C(N=C2C=C1)N(N=C3NC(=O)CCC(=O)O)CC(C)C

InChI

InChI=1S/C19H22N4O3/c1-11(2)10-23-19-14(9-13-8-12(3)4-5-15(13)20-19)18(22-23)21-16(24)6-7-17(25)26/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,25,26)(H,21,22,24)