bis[3-[bis(sulfanyl)methyl]-6-tert-butyl-2,4-dimethyl-phenyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[3-[bis(sulfanyl)methyl]-6-tert-butyl-2,4-dimethyl-phenyl] benzene-1,4-dicarboxylate Openeye Name: bis[3-[bis(sulfanyl)methyl]-6-tert-butyl-2,4-dimethyl-phenyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[6-tert-butyl-3-(dimercaptomethyl)-2,4-dimethylphenyl] ester IUPAC Name: bis[3-[bis(sulfanyl)methyl]-6-tert-butyl-2,4-dimethylphenyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis[6-tert-butyl-3-(dimercaptomethyl)-2,4-dimethyl-phenyl] ester Formula: C34H42O4S4 MolecularWeight: 642.95488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(S)S)C)OC(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C(=C3C)C(S)S)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(S)S)C)OC(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C(=C3C)C(S)S)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C34H42O4S4/c1-17-15-23(33(5,6)7)27(19(3)25(17)31(39)40)37-29(35)21-11-13-22(14-12-21)30(36)38-28-20(4)26(32(41)42)18(2)16-24(28)34(8,9)10/h11-16,31-32,39-42H,1-10H3