methyl (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxidanylidene-4,8a-dihydro-1H-naphthalene-4a-carboxylate

Systemtic Name: methyl (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxidanylidene-4,8a-dihydro-1H-naphthalene-4a-carboxylate Openeye Name: methyl (4S,4aS,8aR)-4-acetoxy-6,8,8-trimethoxy-7-oxo-4,8a-dihydro-1H-naphthalene-4a-carboxylate CAS Name: (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxo-4,8a-dihydro-1H-naphthalene-4a-carboxylic acid methyl ester IUPAC Name: methyl (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxo-4,8a-dihydro-1H-naphthalene-4a-carboxylate Traditional Name: (4S,4aS,8aR)-4-acetoxy-7-keto-6,8,8-trimethoxy-4,8a-dihydro-1H-naphthalene-4a-carboxylic acid methyl ester Formula: C17H22O8 MolecularWeight: 354.35178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CCC2C1(C=C(C(=O)C2(OC)OC)OC)C(=O)OC

Isomeric SMILES

CC(=O)O[C@H]1C=CC[C@@H]2[C@]1(C=C(C(=O)C2(OC)OC)OC)C(=O)OC

InChI

InChI=1S/C17H22O8/c1-10(18)25-13-8-6-7-12-16(13,15(20)22-3)9-11(21-2)14(19)17(12,23-4)24-5/h6,8-9,12-13H,7H2,1-5H3/t12-,13+,16+/m1/s1