4-phenyl-1-[4-(1,2,4-triazol-1-yl)butyl]piperidin-1-ium-4-ol

Systemtic Name: 4-phenyl-1-[4-(1,2,4-triazol-1-yl)butyl]piperidin-1-ium-4-ol Openeye Name: 4-phenyl-1-[4-(1,2,4-triazol-1-yl)butyl]piperidin-1-ium-4-ol CAS Name: 4-phenyl-1-[4-(1,2,4-triazol-1-yl)butyl]-4-piperidin-1-iumol IUPAC Name: 4-phenyl-1-[4-(1,2,4-triazol-1-yl)butyl]piperidin-1-ium-4-ol Traditional Name: 4-phenyl-1-[4-(1,2,4-triazol-1-yl)butyl]piperidin-1-ium-4-ol Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(C2=CC=CC=C2)O)CCCCN3C=NC=N3

Isomeric SMILES

C1C[NH+](CCC1(C2=CC=CC=C2)O)CCCCN3C=NC=N3

InChI

InChI=1S/C17H24N4O/c22-17(16-6-2-1-3-7-16)8-12-20(13-9-17)10-4-5-11-21-15-18-14-19-21/h1-3,6-7,14-15,22H,4-5,8-13H2/p+1