methyl 5-[3-[5-(6-methoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-3-methyl-2-oxidanyl-phenyl]sulfonyl-5-methyl-4-oxidanyl-phenyl]-5-methyl-hexanoate

Systemtic Name: methyl 5-[3-[5-(6-methoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-3-methyl-2-oxidanyl-phenyl]sulfonyl-5-methyl-4-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: methyl 5-[4-hydroxy-3-[2-hydroxy-5-(5-methoxy-1,1-dimethyl-5-oxo-pentyl)-3-methyl-phenyl]sulfonyl-5-methyl-phenyl]-5-methyl-hexanoate CAS Name: 5-[4-hydroxy-3-[2-hydroxy-5-(6-methoxy-2-methyl-6-oxohexan-2-yl)-3-methylphenyl]sulfonyl-5-methylphenyl]-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-[4-hydroxy-3-[2-hydroxy-5-(6-methoxy-2-methyl-6-oxohexan-2-yl)-3-methylphenyl]sulfonyl-5-methylphenyl]-5-methylhexanoate Traditional Name: 5-[4-hydroxy-3-[2-hydroxy-5-(5-keto-5-methoxy-1,1-dimethyl-pentyl)-3-methyl-phenyl]sulfonyl-5-methyl-phenyl]-5-methyl-hexanoic acid methyl ester Formula: C30H42O8S MolecularWeight: 562.71468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)CCCC(=O)OC)S(=O)(=O)C2=CC(=CC(=C2O)C)C(C)(C)CCCC(=O)OC)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)CCCC(=O)OC)S(=O)(=O)C2=CC(=CC(=C2O)C)C(C)(C)CCCC(=O)OC)O

InChI

InChI=1S/C30H42O8S/c1-19-15-21(29(3,4)13-9-11-25(31)37-7)17-23(27(19)33)39(35,36)24-18-22(16-20(2)28(24)34)30(5,6)14-10-12-26(32)38-8/h15-18,33-34H,9-14H2,1-8H3