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

Systemtic Name: 1-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-isobutyl-1-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]triazole-4-carboxamide CAS Name: 1-[1-[(E)-2-methylbut-2-enyl]-4-piperidin-1-iumyl]-N-(2-methylpropyl)-4-triazolecarboxamide IUPAC Name: 1-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]-N-(2-methylpropyl)triazole-4-carboxamide Traditional Name: N-isobutyl-1-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]triazole-4-carboxamide Formula: C17H30N5O+ MolecularWeight: 320.453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)NCC(C)C

InChI

InChI=1S/C17H29N5O/c1-5-14(4)11-21-8-6-15(7-9-21)22-12-16(19-20-22)17(23)18-10-13(2)3/h5,12-13,15H,6-11H2,1-4H3,(H,18,23)/p+1/b14-5+