(9-acetyloxy-9-methyl-5-methylidene-3-oxidanyl-2-propan-2-yl-cyclodecyl) 4-acetyloxybenzoate

Systemtic Name: (9-acetyloxy-9-methyl-5-methylidene-3-oxidanyl-2-propan-2-yl-cyclodecyl) 4-acetyloxybenzoate Openeye Name: (9-acetoxy-3-hydroxy-2-isopropyl-9-methyl-5-methylene-cyclodecyl) 4-acetoxybenzoate CAS Name: 4-acetyloxybenzoic acid (9-acetyloxy-3-hydroxy-9-methyl-5-methylene-2-propan-2-ylcyclodecyl) ester IUPAC Name: (9-acetyloxy-3-hydroxy-9-methyl-5-methylidene-2-propan-2-ylcyclodecyl) 4-acetyloxybenzoate Traditional Name: 4-acetoxybenzoic acid (9-acetoxy-3-hydroxy-2-isopropyl-9-methyl-5-methylene-cyclodecyl) ester Formula: C26H36O7 MolecularWeight: 460.55984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(CC(=C)CCCC(CC1OC(=O)C2=CC=C(C=C2)OC(=O)C)(C)OC(=O)C)O

Isomeric SMILES

CC(C)C1C(CC(=C)CCCC(CC1OC(=O)C2=CC=C(C=C2)OC(=O)C)(C)OC(=O)C)O

InChI

InChI=1S/C26H36O7/c1-16(2)24-22(29)14-17(3)8-7-13-26(6,33-19(5)28)15-23(24)32-25(30)20-9-11-21(12-10-20)31-18(4)27/h9-12,16,22-24,29H,3,7-8,13-15H2,1-2,4-6H3