1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N'-[1-(4-methoxyphenyl)ethenyl]-5-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2,3-triazole-4-carbohydrazide

Systemtic Name: 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N'-[1-(4-methoxyphenyl)ethenyl]-5-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2,3-triazole-4-carbohydrazide Openeye Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1-(4-methoxyphenyl)vinyl]-5-[(4-methylpiperidin-1-ium-1-yl)methyl]triazole-4-carbohydrazide CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1-(4-methoxyphenyl)ethenyl]-5-[(4-methyl-1-piperidin-1-iumyl)methyl]-4-triazolecarbohydrazide IUPAC Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1-(4-methoxyphenyl)ethenyl]-5-[(4-methylpiperidin-1-ium-1-yl)methyl]triazole-4-carbohydrazide Traditional Name: 1-(4-aminofurazan-3-yl)-N'-[1-(4-methoxyphenyl)vinyl]-5-[(4-methylpiperidin-1-ium-1-yl)methyl]triazole-4-carbohydrazide Formula: C21H28N9O3+ MolecularWeight: 454.50552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NNC(=C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NNC(=C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H27N9O3/c1-13-8-10-29(11-9-13)12-17-18(24-28-30(17)20-19(22)26-33-27-20)21(31)25-23-14(2)15-4-6-16(32-3)7-5-15/h4-7,13,23H,2,8-12H2,1,3H3,(H2,22,26)(H,25,31)/p+1