2-(7-oxidanylheptyl)-3-[(E)-3-oxidanylidene-4-phenethyl-oct-1-enyl]cyclopentan-1-one

Systemtic Name: 2-(7-oxidanylheptyl)-3-[(E)-3-oxidanylidene-4-phenethyl-oct-1-enyl]cyclopentan-1-one Openeye Name: 2-(7-hydroxyheptyl)-3-[(E)-3-oxo-4-phenethyl-oct-1-enyl]cyclopentanone CAS Name: 2-(7-hydroxyheptyl)-3-[(E)-3-oxo-4-phenethyloct-1-enyl]-1-cyclopentanone IUPAC Name: 2-(7-hydroxyheptyl)-3-[(E)-3-oxo-4-phenethyloct-1-enyl]cyclopentan-1-one Traditional Name: 2-(7-hydroxyheptyl)-3-[(E)-3-keto-4-phenethyl-oct-1-enyl]cyclopentanone Formula: C28H42O3 MolecularWeight: 426.63128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC1=CC=CC=C1)C(=O)C=CC2CCC(=O)C2CCCCCCCO

Isomeric SMILES

CCCCC(CCC1=CC=CC=C1)C(=O)/C=C/C2CCC(=O)C2CCCCCCCO

InChI

InChI=1S/C28H42O3/c1-2-3-14-25(17-16-23-12-8-7-9-13-23)27(30)20-18-24-19-21-28(31)26(24)15-10-5-4-6-11-22-29/h7-9,12-13,18,20,24-26,29H,2-6,10-11,14-17,19,21-22H2,1H3/b20-18+