5-methyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-methyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C23H27N6O2+ MolecularWeight: 419.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N6O2/c1-17-22(27-29(26-17)20-10-6-3-7-11-20)23(31)25-19-12-14-28(15-13-19)16-21(30)24-18-8-4-2-5-9-18/h2-11,19H,12-16H2,1H3,(H,24,30)(H,25,31)/p+1