(4aR,8aR)-2,2,6-trimethyl-4a-(phenylsulfonyl)-8,8a-dihydro-3H-chromene-4,7-dione

Systemtic Name: (4aR,8aR)-2,2,6-trimethyl-4a-(phenylsulfonyl)-8,8a-dihydro-3H-chromene-4,7-dione Openeye Name: (4aR,8aR)-4a-(benzenesulfonyl)-2,2,6-trimethyl-8,8a-dihydro-3H-chromene-4,7-dione CAS Name: (4aR,8aR)-4a-(benzenesulfonyl)-2,2,6-trimethyl-8,8a-dihydro-3H-1-benzopyran-4,7-dione IUPAC Name: (4aR,8aR)-4a-(benzenesulfonyl)-2,2,6-trimethyl-8,8a-dihydro-3H-chromene-4,7-dione Traditional Name: (4aR,8aR)-4a-besyl-2,2,6-trimethyl-8,8a-dihydro-3H-chromene-4,7-quinone Formula: C18H20O5S MolecularWeight: 348.4134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2(C(CC1=O)OC(CC2=O)(C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C[C@]2([C@@H](CC1=O)OC(CC2=O)(C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20O5S/c1-12-10-18(24(21,22)13-7-5-4-6-8-13)15(20)11-17(2,3)23-16(18)9-14(12)19/h4-8,10,16H,9,11H2,1-3H3/t16-,18+/m1/s1