[1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)piperidin-4-yl]azanium

Systemtic Name: [1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)piperidin-4-yl]azanium Openeye Name: [1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)-4-piperidyl]ammonium CAS Name: [1-(2-butyl-3,4-dimethyl-6-pyrazolo[3,4-b]pyridinyl)-4-piperidinyl]ammonium IUPAC Name: [1-(2-butyl-3,4-dimethylpyrazolo[3,4-b]pyridin-6-yl)piperidin-4-yl]azanium Traditional Name: [1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)-4-piperidyl]ammonium Formula: C17H28N5+ MolecularWeight: 302.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=CC(=NC2=N1)N3CCC(CC3)[NH3+])C)C

Isomeric SMILES

CCCCN1C(=C2C(=CC(=NC2=N1)N3CCC(CC3)[NH3+])C)C

InChI

InChI=1S/C17H27N5/c1-4-5-8-22-13(3)16-12(2)11-15(19-17(16)20-22)21-9-6-14(18)7-10-21/h11,14H,4-10,18H2,1-3H3/p+1