2,4,7,9-tetratert-butyl-11,11-dimethyl-benzo[c][1,2]benzodithiepine-3,8-diol

Systemtic Name: 2,4,7,9-tetratert-butyl-11,11-dimethyl-benzo[c][1,2]benzodithiepine-3,8-diol Openeye Name: 2,4,7,9-tetratert-butyl-11,11-dimethyl-benzo[c][1,2]benzodithiepine-3,8-diol CAS Name: 2,4,7,9-tetratert-butyl-11,11-dimethylbenzo[c][1,2]benzodithiepin-3,8-diol IUPAC Name: 2,4,7,9-tetratert-butyl-11,11-dimethylbenzo[c][1,2]benzodithiepine-3,8-diol Traditional Name: 2,4,7,9-tetratert-butyl-11,11-dimethyl-benzo[c][1,2]benzodithiepin-3,8-diol Formula: C31H46O2S2 MolecularWeight: 514.82574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=C(C(=C2SSC3=C(C(=C(C=C31)C(C)(C)C)O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C)C

Isomeric SMILES

CC1(C2=CC(=C(C(=C2SSC3=C(C(=C(C=C31)C(C)(C)C)O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C)C

InChI

InChI=1S/C31H46O2S2/c1-27(2,3)17-15-19-25(21(23(17)32)29(7,8)9)34-35-26-20(31(19,13)14)16-18(28(4,5)6)24(33)22(26)30(10,11)12/h15-16,32-33H,1-14H3