2-(4-methyl-5-oxidanylidene-1,2-dithiol-3-yl)ethyl nitrate

Systemtic Name: 2-(4-methyl-5-oxidanylidene-1,2-dithiol-3-yl)ethyl nitrate Openeye Name: 2-(4-methyl-5-oxo-dithiol-3-yl)ethyl nitrate CAS Name: nitric acid 2-(4-methyl-5-oxo-3-dithiolyl)ethyl ester IUPAC Name: 2-(4-methyl-5-oxodithiol-3-yl)ethyl nitrate Traditional Name: nitric acid 2-(5-keto-4-methyl-dithiol-3-yl)ethyl ester Formula: C6H7NO4S2 MolecularWeight: 221.25408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SSC1=O)CCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(SSC1=O)CCO[N+](=O)[O-]

InChI

InChI=1S/C6H7NO4S2/c1-4-5(12-13-6(4)8)2-3-11-7(9)10/h2-3H2,1H3