(3aS,6aS)-5-methyl-4,6a-bis(phenylsulfonyl)-2,3,3a,6-tetrahydropentalen-1-one

Systemtic Name: (3aS,6aS)-5-methyl-4,6a-bis(phenylsulfonyl)-2,3,3a,6-tetrahydropentalen-1-one Openeye Name: (3aS,6aS)-4,6a-bis(benzenesulfonyl)-5-methyl-2,3,3a,6-tetrahydropentalen-1-one CAS Name: (3aS,6aS)-4,6a-bis(benzenesulfonyl)-5-methyl-2,3,3a,6-tetrahydropentalen-1-one IUPAC Name: (3aS,6aS)-4,6a-bis(benzenesulfonyl)-5-methyl-2,3,3a,6-tetrahydropentalen-1-one Traditional Name: (3aS,6aS)-4,6a-dibesyl-5-methyl-2,3,3a,6-tetrahydropentalen-1-one Formula: C21H20O5S2 MolecularWeight: 416.5105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2CCC(=O)C2(C1)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C([C@@H]2CCC(=O)[C@@]2(C1)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20O5S2/c1-15-14-21(28(25,26)17-10-6-3-7-11-17)18(12-13-19(21)22)20(15)27(23,24)16-8-4-2-5-9-16/h2-11,18H,12-14H2,1H3/t18-,21-/m0/s1