methyl (6S)-7-(4-methoxyphenyl)sulfonyl-5,5-dimethyl-1,4,7-oxathiazonane-6-carboxylate

Systemtic Name: methyl (6S)-7-(4-methoxyphenyl)sulfonyl-5,5-dimethyl-1,4,7-oxathiazonane-6-carboxylate Openeye Name: methyl (6S)-7-(4-methoxyphenyl)sulfonyl-5,5-dimethyl-1,4,7-oxathiazonane-6-carboxylate CAS Name: (6S)-7-(4-methoxyphenyl)sulfonyl-5,5-dimethyl-1,4,7-oxathiazonane-6-carboxylic acid methyl ester IUPAC Name: methyl (6S)-7-(4-methoxyphenyl)sulfonyl-5,5-dimethyl-1,4,7-oxathiazonane-6-carboxylate Traditional Name: (6S)-7-(4-methoxyphenyl)sulfonyl-5,5-dimethyl-1,4,7-oxathiazonane-6-carboxylic acid methyl ester Formula: C17H25NO6S2 MolecularWeight: 403.5135

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCOCCS1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)OC)C

Isomeric SMILES

CC1([C@@H](N(CCOCCS1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)OC)C

InChI

InChI=1S/C17H25NO6S2/c1-17(2)15(16(19)23-4)18(9-10-24-11-12-25-17)26(20,21)14-7-5-13(22-3)6-8-14/h5-8,15H,9-12H2,1-4H3/t15-/m0/s1