3-(1-methylpiperidin-4-yl)-5-oxidanylidene-N,1-diphenyl-2H-1,2,3-triazol-3-ium-4-carboxamide

Systemtic Name: 3-(1-methylpiperidin-4-yl)-5-oxidanylidene-N,1-diphenyl-2H-1,2,3-triazol-3-ium-4-carboxamide Openeye Name: 3-(1-methyl-4-piperidyl)-5-oxo-N,1-diphenyl-2H-triazol-3-ium-4-carboxamide CAS Name: 3-(1-methyl-4-piperidinyl)-5-oxo-N,1-diphenyl-2H-triazol-3-ium-4-carboxamide IUPAC Name: 3-(1-methylpiperidin-4-yl)-5-oxo-N,1-diphenyl-2H-triazol-3-ium-4-carboxamide Traditional Name: 5-keto-3-(1-methyl-4-piperidyl)-N,1-diphenyl-2H-triazol-3-ium-4-carboxamide Formula: C21H24N5O2+ MolecularWeight: 378.44756

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)[N+]2=C(C(=O)N(N2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CN1CCC(CC1)[N+]2=C(C(=O)N(N2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2/c1-24-14-12-18(13-15-24)25-19(20(27)22-16-8-4-2-5-9-16)21(28)26(23-25)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3,(H-,22,23,27,28)/p+1