3a,6a-dimethyl-3,6-bis(phenylsulfonyl)-1,4-dihydropentalene

Systemtic Name: 3a,6a-dimethyl-3,6-bis(phenylsulfonyl)-1,4-dihydropentalene Openeye Name: 3,6-bis(benzenesulfonyl)-3a,6a-dimethyl-1,4-dihydropentalene CAS Name: 3,6-bis(benzenesulfonyl)-3a,6a-dimethyl-1,4-dihydropentalene IUPAC Name: 3,6-bis(benzenesulfonyl)-3a,6a-dimethyl-1,4-dihydropentalene Traditional Name: 3,6-dibesyl-3a,6a-dimethyl-1,4-dihydropentalene Formula: C22H22O4S2 MolecularWeight: 414.53768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CC=C(C1(CC=C2S(=O)(=O)C3=CC=CC=C3)C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC12CC=C(C1(CC=C2S(=O)(=O)C3=CC=CC=C3)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22O4S2/c1-21-15-13-20(28(25,26)18-11-7-4-8-12-18)22(21,2)16-14-19(21)27(23,24)17-9-5-3-6-10-17/h3-14H,15-16H2,1-2H3