(4aS,8aR)-5-methoxy-2,2-dimethyl-4a-(phenylsulfonyl)-8,8a-dihydro-3H-chromene-4,7-dione

Systemtic Name: (4aS,8aR)-5-methoxy-2,2-dimethyl-4a-(phenylsulfonyl)-8,8a-dihydro-3H-chromene-4,7-dione Openeye Name: (4aS,8aR)-4a-(benzenesulfonyl)-5-methoxy-2,2-dimethyl-8,8a-dihydro-3H-chromene-4,7-dione CAS Name: (4aS,8aR)-4a-(benzenesulfonyl)-5-methoxy-2,2-dimethyl-8,8a-dihydro-3H-1-benzopyran-4,7-dione IUPAC Name: (4aS,8aR)-4a-(benzenesulfonyl)-5-methoxy-2,2-dimethyl-8,8a-dihydro-3H-chromene-4,7-dione Traditional Name: (4aS,8aR)-4a-besyl-5-methoxy-2,2-dimethyl-8,8a-dihydro-3H-chromene-4,7-quinone Formula: C18H20O6S MolecularWeight: 364.4128

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2(C(O1)CC(=O)C=C2OC)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(=O)[C@@]2([C@H](O1)CC(=O)C=C2OC)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H20O6S/c1-17(2)11-14(20)18(25(21,22)13-7-5-4-6-8-13)15(23-3)9-12(19)10-16(18)24-17/h4-9,16H,10-11H2,1-3H3/t16-,18-/m1/s1