[5-[(1,3-dimethylpyrazolo[3,4-b]quinolin-4-yl)amino]-2-oxidanyl-phenyl]methyl-diethyl-azanium

Systemtic Name: [5-[(1,3-dimethylpyrazolo[3,4-b]quinolin-4-yl)amino]-2-oxidanyl-phenyl]methyl-diethyl-azanium Openeye Name: [5-[(1,3-dimethylpyrazolo[3,4-b]quinolin-4-yl)amino]-2-hydroxy-phenyl]methyl-diethyl-ammonium CAS Name: [5-[(1,3-dimethyl-4-pyrazolo[3,4-b]quinolinyl)amino]-2-hydroxyphenyl]methyl-diethylammonium IUPAC Name: [5-[(1,3-dimethylpyrazolo[3,4-b]quinolin-4-yl)amino]-2-hydroxyphenyl]methyl-diethylazanium Traditional Name: [5-[(1,3-dimethylpyrazolo[3,4-b]quinolin-4-yl)amino]-2-hydroxy-benzyl]-diethyl-ammonium Formula: C23H28N5O+ MolecularWeight: 390.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC(=C1)NC2=C3C(=NN(C3=NC4=CC=CC=C42)C)C)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)NC2=C3C(=NN(C3=NC4=CC=CC=C42)C)C)O

InChI

InChI=1S/C23H27N5O/c1-5-28(6-2)14-16-13-17(11-12-20(16)29)24-22-18-9-7-8-10-19(18)25-23-21(22)15(3)26-27(23)4/h7-13,29H,5-6,14H2,1-4H3,(H,24,25)/p+1