5-nitro-7-(1,3-oxathiolan-2-yl)heptan-2-one

Systemtic Name: 5-nitro-7-(1,3-oxathiolan-2-yl)heptan-2-one Openeye Name: 5-nitro-7-(1,3-oxathiolan-2-yl)heptan-2-one CAS Name: 5-nitro-7-(1,3-oxathiolan-2-yl)-2-heptanone IUPAC Name: 5-nitro-7-(1,3-oxathiolan-2-yl)heptan-2-one Traditional Name: 5-nitro-7-(1,3-oxathiolan-2-yl)heptan-2-one Formula: C10H17NO4S MolecularWeight: 247.31128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(CCC1OCCS1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CCC(CCC1OCCS1)[N+](=O)[O-]

InChI

InChI=1S/C10H17NO4S/c1-8(12)2-3-9(11(13)14)4-5-10-15-6-7-16-10/h9-10H,2-7H2,1H3