3-methyl-6-piperazin-4-ium-1-yl-2-propyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine

Systemtic Name: 3-methyl-6-piperazin-4-ium-1-yl-2-propyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Openeye Name: 3-methyl-6-piperazin-4-ium-1-yl-2-propyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine CAS Name: 3-methyl-6-(1-piperazin-4-iumyl)-2-propyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine IUPAC Name: 3-methyl-6-piperazin-4-ium-1-yl-2-propyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Traditional Name: 3-methyl-6-piperazin-4-ium-1-yl-2-propyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Formula: C15H21F3N5+ MolecularWeight: 328.35595

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C2C(=CC(=NC2=N1)N3CC[NH2+]CC3)C(F)(F)F)C

Isomeric SMILES

CCCN1C(=C2C(=CC(=NC2=N1)N3CC[NH2+]CC3)C(F)(F)F)C

InChI

InChI=1S/C15H20F3N5/c1-3-6-23-10(2)13-11(15(16,17)18)9-12(20-14(13)21-23)22-7-4-19-5-8-22/h9,19H,3-8H2,1-2H3/p+1