3-[(E)-2-cyclohexyl-1-(2,4-dimethylphenyl)ethenyl]-4-oxidanyl-oxan-2-one

Systemtic Name: 3-[(E)-2-cyclohexyl-1-(2,4-dimethylphenyl)ethenyl]-4-oxidanyl-oxan-2-one Openeye Name: 3-[(E)-2-cyclohexyl-1-(2,4-dimethylphenyl)vinyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: 3-[(E)-2-cyclohexyl-1-(2,4-dimethylphenyl)ethenyl]-4-hydroxy-2-oxanone IUPAC Name: 3-[(E)-2-cyclohexyl-1-(2,4-dimethylphenyl)ethenyl]-4-hydroxyoxan-2-one Traditional Name: 3-[(E)-2-cyclohexyl-1-(2,4-dimethylphenyl)vinyl]-4-hydroxy-tetrahydropyran-2-one Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=CC2CCCCC2)C3C(CCOC3=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)/C(=C/C2CCCCC2)/C3C(CCOC3=O)O)C

InChI

InChI=1S/C21H28O3/c1-14-8-9-17(15(2)12-14)18(13-16-6-4-3-5-7-16)20-19(22)10-11-24-21(20)23/h8-9,12-13,16,19-20,22H,3-7,10-11H2,1-2H3/b18-13-