N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide CAS Name: N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-4-triazolecarboxamide IUPAC Name: N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Traditional Name: N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Formula: C20H26N7O2+ MolecularWeight: 396.46614

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NN=C(O1)C2=CC=CC=C2)C(=O)C3=CN(N=N3)CC[NH+]4CCCCC4

Isomeric SMILES

CN(CC1=NN=C(O1)C2=CC=CC=C2)C(=O)C3=CN(N=N3)CC[NH+]4CCCCC4

InChI

InChI=1S/C20H25N7O2/c1-25(15-18-22-23-19(29-18)16-8-4-2-5-9-16)20(28)17-14-27(24-21-17)13-12-26-10-6-3-7-11-26/h2,4-5,8-9,14H,3,6-7,10-13,15H2,1H3/p+1