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

Systemtic Name: 1-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-N-(3-oxidanylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-N-(3-hydroxypropyl)triazole-4-carboxamide CAS Name: 1-[(3S)-1-(cyclohexylmethyl)-3-piperidin-1-iumyl]-N-(3-hydroxypropyl)-4-triazolecarboxamide IUPAC Name: 1-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-N-(3-hydroxypropyl)triazole-4-carboxamide Traditional Name: 1-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-N-(3-hydroxypropyl)triazole-4-carboxamide Formula: C18H32N5O2+ MolecularWeight: 350.47898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCCC(C2)N3C=C(N=N3)C(=O)NCCCO

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCC[C@@H](C2)N3C=C(N=N3)C(=O)NCCCO

InChI

InChI=1S/C18H31N5O2/c24-11-5-9-19-18(25)17-14-23(21-20-17)16-8-4-10-22(13-16)12-15-6-2-1-3-7-15/h14-16,24H,1-13H2,(H,19,25)/p+1/t16-/m0/s1