N-methyl-1-[(E)-(4-methylphenyl)methylideneamino]-5-oxidanylidene-3-phenacyl-2H-1,2,3-triazol-3-ium-4-carboxamide

Systemtic Name: N-methyl-1-[(E)-(4-methylphenyl)methylideneamino]-5-oxidanylidene-3-phenacyl-2H-1,2,3-triazol-3-ium-4-carboxamide Openeye Name: N-methyl-5-oxo-3-phenacyl-1-[(E)-p-tolylmethyleneamino]-2H-triazol-3-ium-4-carboxamide CAS Name: N-methyl-1-[(E)-(4-methylphenyl)methylideneamino]-5-oxo-3-phenacyl-2H-triazol-3-ium-4-carboxamide IUPAC Name: N-methyl-1-[(E)-(4-methylphenyl)methylideneamino]-5-oxo-3-phenacyl-2H-triazol-3-ium-4-carboxamide Traditional Name: 5-keto-N-methyl-1-[(E)-(4-methylbenzylidene)amino]-3-phenacyl-2H-triazol-3-ium-4-carboxamide Formula: C20H20N5O3+ MolecularWeight: 378.4045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NN2C(=O)C(=[N+](N2)CC(=O)C3=CC=CC=C3)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/N2C(=O)C(=[N+](N2)CC(=O)C3=CC=CC=C3)C(=O)NC

InChI

InChI=1S/C20H19N5O3/c1-14-8-10-15(11-9-14)12-22-25-20(28)18(19(27)21-2)24(23-25)13-17(26)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H-,21,23,27,28)/p+1/b22-12+