2-butyl-3,4-dimethyl-6-piperazin-4-ium-1-yl-pyrazolo[3,4-b]pyridine

Systemtic Name: 2-butyl-3,4-dimethyl-6-piperazin-4-ium-1-yl-pyrazolo[3,4-b]pyridine Openeye Name: 2-butyl-3,4-dimethyl-6-piperazin-4-ium-1-yl-pyrazolo[3,4-b]pyridine CAS Name: 2-butyl-3,4-dimethyl-6-(1-piperazin-4-iumyl)pyrazolo[3,4-b]pyridine IUPAC Name: 2-butyl-3,4-dimethyl-6-piperazin-4-ium-1-ylpyrazolo[3,4-b]pyridine Traditional Name: 2-butyl-3,4-dimethyl-6-piperazin-4-ium-1-yl-pyrazolo[3,4-b]pyridine Formula: C16H26N5+ MolecularWeight: 288.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=CC(=NC2=N1)N3CC[NH2+]CC3)C)C

Isomeric SMILES

CCCCN1C(=C2C(=CC(=NC2=N1)N3CC[NH2+]CC3)C)C

InChI

InChI=1S/C16H25N5/c1-4-5-8-21-13(3)15-12(2)11-14(18-16(15)19-21)20-9-6-17-7-10-20/h11,17H,4-10H2,1-3H3/p+1