5-(4-ethylhexyl)-3-nitro-1,2-thiazole

Systemtic Name: 5-(4-ethylhexyl)-3-nitro-1,2-thiazole Openeye Name: 5-(4-ethylhexyl)-3-nitro-isothiazole CAS Name: 5-(4-ethylhexyl)-3-nitroisothiazole IUPAC Name: 5-(4-ethylhexyl)-3-nitro-1,2-thiazole Traditional Name: 5-(4-ethylhexyl)-3-nitro-isothiazole Formula: C11H18N2O2S MolecularWeight: 242.33782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCCC1=CC(=NS1)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)CCCC1=CC(=NS1)[N+](=O)[O-]

InChI

InChI=1S/C11H18N2O2S/c1-3-9(4-2)6-5-7-10-8-11(12-16-10)13(14)15/h8-9H,3-7H2,1-2H3