[(1E,7S,8S,9R)-7,9-diacetyloxy-5-methylidene-6-oxidanylidene-8-propan-2-yl-cyclodecen-1-yl]methyl ethanoate

Systemtic Name: [(1E,7S,8S,9R)-7,9-diacetyloxy-5-methylidene-6-oxidanylidene-8-propan-2-yl-cyclodecen-1-yl]methyl ethanoate Openeye Name: [(1E,7S,8S,9R)-7,9-diacetoxy-8-isopropyl-5-methylene-6-oxo-cyclodecen-1-yl]methyl acetate CAS Name: acetic acid [(1E,7S,8S,9R)-7,9-diacetyloxy-5-methylene-6-oxo-8-propan-2-yl-1-cyclodecenyl]methyl ester IUPAC Name: [(1E,7S,8S,9R)-7,9-diacetyloxy-5-methylidene-6-oxo-8-propan-2-ylcyclodecen-1-yl]methyl acetate Traditional Name: acetic acid [(1E,7S,8S,9R)-7,9-diacetoxy-8-isopropyl-6-keto-5-methylene-cyclodecen-1-yl]methyl ester Formula: C21H30O7 MolecularWeight: 394.4587

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(CC(=CCCC(=C)C(=O)C1OC(=O)C)COC(=O)C)OC(=O)C

Isomeric SMILES

CC(C)[C@H]1[C@@H](C/C(=C\CCC(=C)C(=O)[C@H]1OC(=O)C)/COC(=O)C)OC(=O)C

InChI

InChI=1S/C21H30O7/c1-12(2)19-18(27-15(5)23)10-17(11-26-14(4)22)9-7-8-13(3)20(25)21(19)28-16(6)24/h9,12,18-19,21H,3,7-8,10-11H2,1-2,4-6H3/b17-9+/t18-,19+,21+/m1/s1