dipropan-2-yl (3R,7S)-1,2-dithiepane-3,7-dicarboxylate

Systemtic Name: dipropan-2-yl (3R,7S)-1,2-dithiepane-3,7-dicarboxylate Openeye Name: diisopropyl (3R,7S)-dithiepane-3,7-dicarboxylate CAS Name: (3R,7S)-dithiepane-3,7-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl (3R,7S)-dithiepane-3,7-dicarboxylate Traditional Name: (3R,7S)-dithiepane-3,7-dicarboxylic acid diisopropyl ester Formula: C13H22O4S2 MolecularWeight: 306.44138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1CCCC(SS1)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)[C@H]1CCC[C@H](SS1)C(=O)OC(C)C

InChI

InChI=1S/C13H22O4S2/c1-8(2)16-12(14)10-6-5-7-11(19-18-10)13(15)17-9(3)4/h8-11H,5-7H2,1-4H3/t10-,11+