methyl (1R,2R)-6-methyl-1,2,8-tris(oxidanyl)-9-oxidanylidene-3,4-dihydro-2H-xanthene-1-carboxylate

Systemtic Name: methyl (1R,2R)-6-methyl-1,2,8-tris(oxidanyl)-9-oxidanylidene-3,4-dihydro-2H-xanthene-1-carboxylate Openeye Name: methyl (1R,2R)-1,2,8-trihydroxy-6-methyl-9-oxo-3,4-dihydro-2H-xanthene-1-carboxylate CAS Name: (1R,2R)-1,2,8-trihydroxy-6-methyl-9-oxo-3,4-dihydro-2H-xanthene-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-1,2,8-trihydroxy-6-methyl-9-oxo-3,4-dihydro-2H-xanthene-1-carboxylate Traditional Name: (1R,2R)-1,2,8-trihydroxy-9-keto-6-methyl-3,4-dihydro-2H-xanthene-1-carboxylic acid methyl ester Formula: C16H16O7 MolecularWeight: 320.29404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)O)C(=O)C3=C(O2)CCC(C3(C(=O)OC)O)O

Isomeric SMILES

CC1=CC2=C(C(=C1)O)C(=O)C3=C(O2)CC[C@H]([C@]3(C(=O)OC)O)O

InChI

InChI=1S/C16H16O7/c1-7-5-8(17)12-10(6-7)23-9-3-4-11(18)16(21,15(20)22-2)13(9)14(12)19/h5-6,11,17-18,21H,3-4H2,1-2H3/t11-,16+/m1/s1