4-[(1-ethyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(1-ethyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(1-ethyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxo-butanoate CAS Name: 4-[(1-ethyl-6-methyl-3-pyrazolo[3,4-b]quinolinyl)amino]-4-oxobutanoate IUPAC Name: 4-[(1-ethyl-6-methylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoate Traditional Name: 4-[(1-ethyl-6-methyl-pyrazolo[3,4-b]quinolin-3-yl)amino]-4-keto-butyrate Formula: C17H17N4O3- MolecularWeight: 325.34188

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C3C=C(C=CC3=N2)C)C(=N1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C3C=C(C=CC3=N2)C)C(=N1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H18N4O3/c1-3-21-17-12(9-11-8-10(2)4-5-13(11)18-17)16(20-21)19-14(22)6-7-15(23)24/h4-5,8-9H,3,6-7H2,1-2H3,(H,23,24)(H,19,20,22)/p-1