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

Systemtic Name: 4-[(E)-4-cyclohexyl-4-oxidanyl-but-1-enyl]-2-methylidene-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one Openeye Name: 4-[(E)-4-cyclohexyl-4-hydroxy-but-1-enyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one CAS Name: 4-[(E)-4-cyclohexyl-4-hydroxybut-1-enyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one IUPAC Name: 4-[(E)-4-cyclohexyl-4-hydroxybut-1-enyl]-5-hydroxy-2-methylidene-3,3a,4,5,6,6a-hexahydropentalen-1-one Traditional Name: 4-[(E)-4-cyclohexyl-4-hydroxy-but-1-enyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one Formula: C19H28O3 MolecularWeight: 304.42382

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CC2C(C1=O)CC(C2C=CCC(C3CCCCC3)O)O

Isomeric SMILES

C=C1CC2C(C1=O)CC(C2/C=C/CC(C3CCCCC3)O)O

InChI

InChI=1S/C19H28O3/c1-12-10-15-14(18(21)11-16(15)19(12)22)8-5-9-17(20)13-6-3-2-4-7-13/h5,8,13-18,20-21H,1-4,6-7,9-11H2/b8-5+