N,1-bis(4-methylphenyl)-5-oxidanylidene-3-(oxiran-2-ylmethyl)-2H-1,2,3-triazol-3-ium-4-carboxamide

Systemtic Name: N,1-bis(4-methylphenyl)-5-oxidanylidene-3-(oxiran-2-ylmethyl)-2H-1,2,3-triazol-3-ium-4-carboxamide Openeye Name: 3-(oxiran-2-ylmethyl)-5-oxo-N,1-bis(p-tolyl)-2H-triazol-3-ium-4-carboxamide CAS Name: N,1-bis(4-methylphenyl)-3-(2-oxiranylmethyl)-5-oxo-2H-triazol-3-ium-4-carboxamide IUPAC Name: N,1-bis(4-methylphenyl)-3-(oxiran-2-ylmethyl)-5-oxo-2H-triazol-3-ium-4-carboxamide Traditional Name: 3-glycidyl-5-keto-N,1-bis(p-tolyl)-2H-triazol-3-ium-4-carboxamide Formula: C20H21N4O3+ MolecularWeight: 365.40574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=[N+](NN(C2=O)C3=CC=C(C=C3)C)CC4CO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=[N+](NN(C2=O)C3=CC=C(C=C3)C)CC4CO4

InChI

InChI=1S/C20H20N4O3/c1-13-3-7-15(8-4-13)21-19(25)18-20(26)24(16-9-5-14(2)6-10-16)22-23(18)11-17-12-27-17/h3-10,17H,11-12H2,1-2H3,(H-,21,22,25,26)/p+1