methyl 5-(dimethylamino)-2-ethanoyl-1,3-dithiane-2-carboxylate

Systemtic Name: methyl 5-(dimethylamino)-2-ethanoyl-1,3-dithiane-2-carboxylate Openeye Name: methyl 2-acetyl-5-(dimethylamino)-1,3-dithiane-2-carboxylate CAS Name: 2-acetyl-5-(dimethylamino)-1,3-dithiane-2-carboxylic acid methyl ester IUPAC Name: methyl 2-acetyl-5-(dimethylamino)-1,3-dithiane-2-carboxylate Traditional Name: 2-acetyl-5-(dimethylamino)-1,3-dithiane-2-carboxylic acid methyl ester Formula: C10H17NO3S2 MolecularWeight: 263.37688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(SCC(CS1)N(C)C)C(=O)OC

Isomeric SMILES

CC(=O)C1(SCC(CS1)N(C)C)C(=O)OC

InChI

InChI=1S/C10H17NO3S2/c1-7(12)10(9(13)14-4)15-5-8(6-16-10)11(2)3/h8H,5-6H2,1-4H3