4-[(1E)-4-cyclohexyl-4-oxidanyl-hexa-1,5-dienyl]-2-methylidene-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one

Systemtic Name: 4-[(1E)-4-cyclohexyl-4-oxidanyl-hexa-1,5-dienyl]-2-methylidene-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one Openeye Name: 4-[(1E)-4-cyclohexyl-4-hydroxy-hexa-1,5-dienyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one CAS Name: 4-[(1E)-4-cyclohexyl-4-hydroxyhexa-1,5-dienyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one IUPAC Name: 4-[(1E)-4-cyclohexyl-4-hydroxyhexa-1,5-dienyl]-5-hydroxy-2-methylidene-3,3a,4,5,6,6a-hexahydropentalen-1-one Traditional Name: 4-[(1E)-4-cyclohexyl-4-hydroxy-hexa-1,5-dienyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(CC=CC1C(CC2C1CC(=C)C2=O)O)(C3CCCCC3)O

Isomeric SMILES

C=CC(C/C=C/C1C(CC2C1CC(=C)C2=O)O)(C3CCCCC3)O

InChI

InChI=1S/C21H30O3/c1-3-21(24,15-8-5-4-6-9-15)11-7-10-16-17-12-14(2)20(23)18(17)13-19(16)22/h3,7,10,15-19,22,24H,1-2,4-6,8-9,11-13H2/b10-7+