4-nitro-1,2-thiazol-3-one

Systemtic Name: 4-nitro-1,2-thiazol-3-one Openeye Name: 4-nitroisothiazol-3-one CAS Name: 4-nitro-3-isothiazolone IUPAC Name: 4-nitro-1,2-thiazol-3-one Traditional Name: 4-nitro-4-isothiazolin-3-one Formula: C3H2N2O3S MolecularWeight: 146.12458

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NS1)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=O)NS1)[N+](=O)[O-]

InChI

InChI=1S/C3H2N2O3S/c6-3-2(5(7)8)1-9-4-3/h1H,(H,4,6)