methyl 8-[(3S)-2,2-dimethyl-3-(oxidanylcarbamoyl)thiomorpholin-4-yl]sulfonyldibenzofuran-3-carboxylate

Systemtic Name: methyl 8-[(3S)-2,2-dimethyl-3-(oxidanylcarbamoyl)thiomorpholin-4-yl]sulfonyldibenzofuran-3-carboxylate Openeye Name: methyl 8-[(3S)-3-(hydroxycarbamoyl)-2,2-dimethyl-thiomorpholin-4-yl]sulfonyldibenzofuran-3-carboxylate CAS Name: 8-[[(3S)-3-[(hydroxyamino)-oxomethyl]-2,2-dimethyl-4-thiomorpholinyl]sulfonyl]-3-dibenzofurancarboxylic acid methyl ester IUPAC Name: methyl 8-[(3S)-3-(hydroxycarbamoyl)-2,2-dimethylthiomorpholin-4-yl]sulfonyldibenzofuran-3-carboxylate Traditional Name: 8-[(3S)-3-(hydroxycarbamoyl)-2,2-dimethyl-thiomorpholin-4-yl]sulfonyldibenzofuran-3-carboxylic acid methyl ester Formula: C21H22N2O7S2 MolecularWeight: 478.53858

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)C(=O)OC)C(=O)NO)C

Isomeric SMILES

CC1([C@@H](N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)C(=O)OC)C(=O)NO)C

InChI

InChI=1S/C21H22N2O7S2/c1-21(2)18(19(24)22-26)23(8-9-31-21)32(27,28)13-5-7-16-15(11-13)14-6-4-12(20(25)29-3)10-17(14)30-16/h4-7,10-11,18,26H,8-9H2,1-3H3,(H,22,24)/t18-/m0/s1