1,1,7,7-tetraphenyl-2,6-bis(phenylsulfonyl)heptane-1,7-diol

Systemtic Name: 1,1,7,7-tetraphenyl-2,6-bis(phenylsulfonyl)heptane-1,7-diol Openeye Name: 2,6-bis(benzenesulfonyl)-1,1,7,7-tetraphenyl-heptane-1,7-diol CAS Name: 2,6-bis(benzenesulfonyl)-1,1,7,7-tetraphenylheptane-1,7-diol IUPAC Name: 2,6-bis(benzenesulfonyl)-1,1,7,7-tetraphenylheptane-1,7-diol Traditional Name: 2,6-dibesyl-1,1,7,7-tetraphenyl-heptane-1,7-diol Formula: C43H40O6S2 MolecularWeight: 716.9041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(CCCC(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)S(=O)(=O)C5=CC=CC=C5)S(=O)(=O)C6=CC=CC=C6)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(CCCC(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)S(=O)(=O)C5=CC=CC=C5)S(=O)(=O)C6=CC=CC=C6)O

InChI

InChI=1S/C43H40O6S2/c44-42(34-20-7-1-8-21-34,35-22-9-2-10-23-35)40(50(46,47)38-28-15-5-16-29-38)32-19-33-41(51(48,49)39-30-17-6-18-31-39)43(45,36-24-11-3-12-25-36)37-26-13-4-14-27-37/h1-18,20-31,40-41,44-45H,19,32-33H2