methyl 1-(dimethylcarbamoyl)-1-sulfanyl-pyrrolidin-1-ium-3-carboxylate; 3-methyloxiran-2-one

Systemtic Name: methyl 1-(dimethylcarbamoyl)-1-sulfanyl-pyrrolidin-1-ium-3-carboxylate; 3-methyloxiran-2-one Openeye Name: methyl 1-(dimethylcarbamoyl)-1-sulfanyl-pyrrolidin-1-ium-3-carboxylate; 3-methyloxiran-2-one CAS Name: 1-[dimethylamino(oxo)methyl]-1-mercapto-3-pyrrolidin-1-iumcarboxylic acid methyl ester; 3-methyl-2-oxiranone IUPAC Name: methyl 1-(dimethylcarbamoyl)-1-sulfanylpyrrolidin-1-ium-3-carboxylate; 3-methyloxiran-2-one Traditional Name: 1-(dimethylcarbamoyl)-1-mercapto-pyrrolidin-1-ium-3-carboxylic acid methyl ester; 3-methyloxiran-2-one Formula: C12H21N2O5S+ MolecularWeight: 305.37054

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)O1.CN(C)C(=O)[N+]1(CCC(C1)C(=O)OC)S

Isomeric SMILES

CC1C(=O)O1.CN(C)C(=O)[N+]1(CCC(C1)C(=O)OC)S

InChI

InChI=1S/C9H17N2O3S.C3H4O2/c1-10(2)9(13)11(15)5-4-7(6-11)8(12)14-3;1-2-3(4)5-2/h7,15H,4-6H2,1-3H3;2H,1H3/q+1;