(3aS,6aS)-2,5-bis[(4-chlorophenyl)sulfonyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene

Systemtic Name: (3aS,6aS)-2,5-bis[(4-chlorophenyl)sulfonyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene Openeye Name: (3aS,6aS)-2,5-bis[(4-chlorophenyl)sulfonyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene CAS Name: (3aS,6aS)-2,5-bis[(4-chlorophenyl)sulfonyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene IUPAC Name: (3aS,6aS)-2,5-bis[(4-chlorophenyl)sulfonyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene Traditional Name: (3aS,6aS)-2,5-bis[(4-chlorophenyl)sulfonyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene Formula: C23H22Cl2O4S2 MolecularWeight: 497.45438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(=CC1(CC(=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)C)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC[C@@]12CC(=C[C@@]1(CC(=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)C)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22Cl2O4S2/c1-3-23-14-20(30(26,27)18-8-4-16(24)5-9-18)12-22(23,2)13-21(15-23)31(28,29)19-10-6-17(25)7-11-19/h4-12,15H,3,13-14H2,1-2H3/t22-,23+/m1/s1