ethanenitrile; hydrogen sulfate; methylazanium

Systemtic Name: ethanenitrile; hydrogen sulfate; methylazanium Openeye Name: acetonitrile; hydrogen sulfate; methylammonium CAS Name: acetonitrile; hydrogen sulfate; methylammonium IUPAC Name: acetonitrile; hydrogen sulfate; methylazanium Traditional Name: acetonitrile; methylammonium; bisulfate Formula: C3H10N2O4S MolecularWeight: 170.1875

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.C[NH3+].OS(=O)(=O)[O-]

Isomeric SMILES

CC#N.C[NH3+].OS(=O)(=O)[O-]

InChI

InChI=1S/C2H3N.CH5N.H2O4S/c1-2-3;1-2;1-5(2,3)4/h1H3;2H2,1H3;(H2,1,2,3,4)