(1Z)-4-(ethoxymethyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)benzenecarboximidate

Systemtic Name: (1Z)-4-(ethoxymethyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)benzenecarboximidate Openeye Name: (1Z)-4-(ethoxymethyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)benzenecarboximidate CAS Name: (1Z)-4-(ethoxymethyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)benzenecarboximidate IUPAC Name: (1Z)-4-(ethoxymethyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)benzenecarboximidate Traditional Name: (1Z)-4-(ethoxymethyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)benzenecarboximidate Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)C(=N[N+]2=CN(N=C2)C)[O-]

Isomeric SMILES

CCOCC1=CC=C(C=C1)/C(=N/[N+]2=CN(N=C2)C)/[O-]

InChI

InChI=1S/C13H16N4O2/c1-3-19-8-11-4-6-12(7-5-11)13(18)15-17-9-14-16(2)10-17/h4-7,9-10H,3,8H2,1-2H3