1-[1-(4-oxidanyl-4-phenyl-3H-1,2,4-triazol-4-ium-2-yl)butyl]piperidine

Systemtic Name: 1-[1-(4-oxidanyl-4-phenyl-3H-1,2,4-triazol-4-ium-2-yl)butyl]piperidine Openeye Name: 1-[1-(4-hydroxy-4-phenyl-3H-1,2,4-triazol-4-ium-2-yl)butyl]piperidine CAS Name: 1-[1-(4-hydroxy-4-phenyl-3H-1,2,4-triazol-4-ium-2-yl)butyl]piperidine IUPAC Name: 1-[1-(4-hydroxy-4-phenyl-3H-1,2,4-triazol-4-ium-2-yl)butyl]piperidine Traditional Name: 1-[1-(4-hydroxy-4-phenyl-3H-1,2,4-triazol-4-ium-2-yl)butyl]piperidine Formula: C17H27N4O+ MolecularWeight: 303.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(N1CCCCC1)N2C[N+](C=N2)(C3=CC=CC=C3)O

Isomeric SMILES

CCCC(N1CCCCC1)N2C[N+](C=N2)(C3=CC=CC=C3)O

InChI

InChI=1S/C17H27N4O/c1-2-9-17(19-12-7-4-8-13-19)20-15-21(22,14-18-20)16-10-5-3-6-11-16/h3,5-6,10-11,14,17,22H,2,4,7-9,12-13,15H2,1H3/q+1