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

Systemtic Name: N-(2-methoxyethyl)-1-[1-(2-methylpropyl)piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(1-isobutylpiperidin-1-ium-4-yl)-N-(2-methoxyethyl)triazole-4-carboxamide CAS Name: N-(2-methoxyethyl)-1-[1-(2-methylpropyl)-4-piperidin-1-iumyl]-4-triazolecarboxamide IUPAC Name: N-(2-methoxyethyl)-1-[1-(2-methylpropyl)piperidin-1-ium-4-yl]triazole-4-carboxamide Traditional Name: 1-(1-isobutylpiperidin-1-ium-4-yl)-N-(2-methoxyethyl)triazole-4-carboxamide Formula: C15H28N5O2+ MolecularWeight: 310.41512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H27N5O2/c1-12(2)10-19-7-4-13(5-8-19)20-11-14(17-18-20)15(21)16-6-9-22-3/h11-13H,4-10H2,1-3H3,(H,16,21)/p+1