3-(cyanomethyl)-N,1-bis(3-methoxyphenyl)-5-oxidanylidene-2H-1,2,3-triazol-3-ium-4-carboxamide

Systemtic Name: 3-(cyanomethyl)-N,1-bis(3-methoxyphenyl)-5-oxidanylidene-2H-1,2,3-triazol-3-ium-4-carboxamide Openeye Name: 3-(cyanomethyl)-N,1-bis(3-methoxyphenyl)-5-oxo-2H-triazol-3-ium-4-carboxamide CAS Name: 3-(cyanomethyl)-N,1-bis(3-methoxyphenyl)-5-oxo-2H-triazol-3-ium-4-carboxamide IUPAC Name: 3-(cyanomethyl)-N,1-bis(3-methoxyphenyl)-5-oxo-2H-triazol-3-ium-4-carboxamide Traditional Name: 3-(cyanomethyl)-5-keto-N,1-bis(3-methoxyphenyl)-2H-triazol-3-ium-4-carboxamide Formula: C19H18N5O4+ MolecularWeight: 380.37732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2=[N+](NN(C2=O)C3=CC(=CC=C3)OC)CC#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2=[N+](NN(C2=O)C3=CC(=CC=C3)OC)CC#N

InChI

InChI=1S/C19H17N5O4/c1-27-15-7-3-5-13(11-15)21-18(25)17-19(26)24(22-23(17)10-9-20)14-6-4-8-16(12-14)28-2/h3-8,11-12H,10H2,1-2H3,(H-,21,22,25,26)/p+1