N-cyclopropyl-1-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-cyclopropyl-1-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-cyclopropyl-1-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]triazole-4-carboxamide CAS Name: N-cyclopropyl-1-[1-[(2R)-2,6-dimethylhept-5-enyl]-4-piperidin-1-iumyl]-4-triazolecarboxamide IUPAC Name: N-cyclopropyl-1-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]triazole-4-carboxamide Traditional Name: N-cyclopropyl-1-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]triazole-4-carboxamide Formula: C20H34N5O+ MolecularWeight: 360.51686

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)C[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)NC3CC3

Isomeric SMILES

C[C@H](CCC=C(C)C)C[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)NC3CC3

InChI

InChI=1S/C20H33N5O/c1-15(2)5-4-6-16(3)13-24-11-9-18(10-12-24)25-14-19(22-23-25)20(26)21-17-7-8-17/h5,14,16-18H,4,6-13H2,1-3H3,(H,21,26)/p+1/t16-/m1/s1