methyl (7E)-7-[4-chloranyl-2-(3,7-dimethyloctyl)-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoate

Systemtic Name: methyl (7E)-7-[4-chloranyl-2-(3,7-dimethyloctyl)-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoate Openeye Name: methyl (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-oxo-cyclopent-3-en-1-ylidene]heptanoate CAS Name: (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-oxo-1-cyclopent-3-enylidene]heptanoic acid methyl ester IUPAC Name: methyl (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-oxocyclopent-3-en-1-ylidene]heptanoate Traditional Name: (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-keto-cyclopent-3-en-1-ylidene]enanthic acid methyl ester Formula: C23H37ClO4 MolecularWeight: 412.99048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCC1(C=C(C(=O)C1=CCCCCCC(=O)OC)Cl)O

Isomeric SMILES

CC(C)CCCC(C)CCC\1(C=C(C(=O)/C1=C/CCCCCC(=O)OC)Cl)O

InChI

InChI=1S/C23H37ClO4/c1-17(2)10-9-11-18(3)14-15-23(27)16-20(24)22(26)19(23)12-7-5-6-8-13-21(25)28-4/h12,16-18,27H,5-11,13-15H2,1-4H3/b19-12-