1-cyclopentyl-3-methyl-6-(1-oxidanidylpyridin-1-ium-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-cyclopentyl-3-methyl-6-(1-oxidanidylpyridin-1-ium-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-cyclopentyl-3-methyl-6-(1-oxidopyridin-1-ium-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-cyclopentyl-3-methyl-6-(1-oxido-4-pyridin-1-iumyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-cyclopentyl-3-methyl-6-(1-oxidopyridin-1-ium-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-cyclopentyl-3-methyl-6-(1-oxidopyridin-1-ium-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=O)C3=CC=[N+](C=C3)[O-])N(N1)C4CCCC4

Isomeric SMILES

CC1=C2C(=NC(=NC2=O)C3=CC=[N+](C=C3)[O-])N(N1)C4CCCC4

InChI

InChI=1S/C16H17N5O2/c1-10-13-15(21(19-10)12-4-2-3-5-12)17-14(18-16(13)22)11-6-8-20(23)9-7-11/h6-9,12,19H,2-5H2,1H3