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

Systemtic Name: 1-[(3S)-1-(2-ethylbutyl)piperidin-1-ium-3-yl]-N-(2-hydroxyethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(3S)-1-(2-ethylbutyl)piperidin-1-ium-3-yl]-N-(2-hydroxyethyl)triazole-4-carboxamide CAS Name: 1-[(3S)-1-(2-ethylbutyl)-3-piperidin-1-iumyl]-N-(2-hydroxyethyl)-4-triazolecarboxamide IUPAC Name: 1-[(3S)-1-(2-ethylbutyl)piperidin-1-ium-3-yl]-N-(2-hydroxyethyl)triazole-4-carboxamide Traditional Name: 1-[(3S)-1-(2-ethylbutyl)piperidin-1-ium-3-yl]-N-(2-hydroxyethyl)triazole-4-carboxamide Formula: C16H30N5O2+ MolecularWeight: 324.4417

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C[NH+]1CCCC(C1)N2C=C(N=N2)C(=O)NCCO

Isomeric SMILES

CCC(CC)C[NH+]1CCC[C@@H](C1)N2C=C(N=N2)C(=O)NCCO

InChI

InChI=1S/C16H29N5O2/c1-3-13(4-2)10-20-8-5-6-14(11-20)21-12-15(18-19-21)16(23)17-7-9-22/h12-14,22H,3-11H2,1-2H3,(H,17,23)/p+1/t14-/m0/s1