1-methyl-1,3,5-triazin-1-ium ethanoate

Systemtic Name: 1-methyl-1,3,5-triazin-1-ium ethanoate Openeye Name: 1-methyl-1,3,5-triazin-1-ium acetate CAS Name: 1-methyl-1,3,5-triazin-1-ium acetate IUPAC Name: 1-methyl-1,3,5-triazin-1-ium acetate Traditional Name: 1-methyl-s-triazin-1-ium acetate Formula: C6H9N3O2 MolecularWeight: 155.15456

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C[N+]1=CN=CN=C1

Isomeric SMILES

CC(=O)[O-].C[N+]1=CN=CN=C1

InChI

InChI=1S/C4H6N3.C2H4O2/c1-7-3-5-2-6-4-7;1-2(3)4/h2-4H,1H3;1H3,(H,3,4)/q+1;/p-1