bis(2-ethyl-2-adamantyl) 4-(trioxidanylsulfanyl)benzene-1,2-dicarboxylate

Systemtic Name: bis(2-ethyl-2-adamantyl) 4-(trioxidanylsulfanyl)benzene-1,2-dicarboxylate Openeye Name: bis(2-ethyl-2-adamantyl) 4-(trioxidanylsulfanyl)benzene-1,2-dicarboxylate CAS Name: 4-(trioxidanylthio)benzene-1,2-dicarboxylic acid bis(2-ethyl-2-adamantyl) ester IUPAC Name: bis(2-ethyl-2-adamantyl) 4-(trioxidanylsulfanyl)benzene-1,2-dicarboxylate Traditional Name: 4-(trioxidanylthio)benzene-1,2-dicarboxylic acid bis(2-ethyl-2-adamantyl) ester Formula: C32H42O7S MolecularWeight: 570.73668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2CC3CC(C2)CC1C3)OC(=O)C4=C(C=C(C=C4)SOOO)C(=O)OC5(C6CC7CC(C6)CC5C7)CC

Isomeric SMILES

CCC1(C2CC3CC(C2)CC1C3)OC(=O)C4=C(C=C(C=C4)SOOO)C(=O)OC5(C6CC7CC(C6)CC5C7)CC

InChI

InChI=1S/C32H42O7S/c1-3-31(22-9-18-7-19(11-22)12-23(31)10-18)36-29(33)27-6-5-26(40-39-38-35)17-28(27)30(34)37-32(4-2)24-13-20-8-21(15-24)16-25(32)14-20/h5-6,17-25,35H,3-4,7-16H2,1-2H3