1-[1-(2-ethylbutyl)piperidin-1-ium-4-yl]-N-(3-oxidanylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[1-(2-ethylbutyl)piperidin-1-ium-4-yl]-N-(3-oxidanylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[1-(2-ethylbutyl)piperidin-1-ium-4-yl]-N-(3-hydroxypropyl)triazole-4-carboxamide CAS Name: 1-[1-(2-ethylbutyl)-4-piperidin-1-iumyl]-N-(3-hydroxypropyl)-4-triazolecarboxamide IUPAC Name: 1-[1-(2-ethylbutyl)piperidin-1-ium-4-yl]-N-(3-hydroxypropyl)triazole-4-carboxamide Traditional Name: 1-[1-(2-ethylbutyl)piperidin-1-ium-4-yl]-N-(3-hydroxypropyl)triazole-4-carboxamide Formula: C17H32N5O2+ MolecularWeight: 338.46828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)NCCCO

Isomeric SMILES

CCC(CC)C[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)NCCCO

InChI

InChI=1S/C17H31N5O2/c1-3-14(4-2)12-21-9-6-15(7-10-21)22-13-16(19-20-22)17(24)18-8-5-11-23/h13-15,23H,3-12H2,1-2H3,(H,18,24)/p+1