(12R)-12-methyl-3,3-bis(phenylsulfanyl)-1-oxacyclotridecane-2,10-dione

Systemtic Name: (12R)-12-methyl-3,3-bis(phenylsulfanyl)-1-oxacyclotridecane-2,10-dione Openeye Name: (12R)-12-methyl-3,3-bis(phenylsulfanyl)-oxacyclotridecane-2,10-dione CAS Name: (12R)-12-methyl-3,3-bis(phenylthio)-oxacyclotridecane-2,10-dione IUPAC Name: (12R)-12-methyl-3,3-bis(phenylsulfanyl)-oxacyclotridecane-2,10-dione Traditional Name: (12R)-12-methyl-3,3-bis(phenylthio)-oxacyclotridecane-2,10-quinone Formula: C25H30O3S2 MolecularWeight: 442.6339

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)CCCCCCC(C(=O)OC1)(SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC(=O)CCCCCCC(C(=O)OC1)(SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C25H30O3S2/c1-20-18-21(26)12-6-2-3-11-17-25(24(27)28-19-20,29-22-13-7-4-8-14-22)30-23-15-9-5-10-16-23/h4-5,7-10,13-16,20H,2-3,6,11-12,17-19H2,1H3/t20-/m1/s1