(2R,3R,4S)-4-oxidanyl-3-[(E)-8-oxidanyloct-1-enyl]-2-(phenylmethyl)cyclopentan-1-one

Systemtic Name: (2R,3R,4S)-4-oxidanyl-3-[(E)-8-oxidanyloct-1-enyl]-2-(phenylmethyl)cyclopentan-1-one Openeye Name: (2R,3R,4S)-2-benzyl-4-hydroxy-3-[(E)-8-hydroxyoct-1-enyl]cyclopentanone CAS Name: (2R,3R,4S)-4-hydroxy-3-[(E)-8-hydroxyoct-1-enyl]-2-(phenylmethyl)-1-cyclopentanone IUPAC Name: (2R,3R,4S)-2-benzyl-4-hydroxy-3-[(E)-8-hydroxyoct-1-enyl]cyclopentan-1-one Traditional Name: (2R,3R,4S)-2-benzyl-4-hydroxy-3-[(E)-8-hydroxyoct-1-enyl]cyclopentanone Formula: C20H28O3 MolecularWeight: 316.43452

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1=O)CC2=CC=CC=C2)C=CCCCCCCO)O

Isomeric SMILES

C1[C@@H]([C@@H]([C@H](C1=O)CC2=CC=CC=C2)/C=C/CCCCCCO)O

InChI

InChI=1S/C20H28O3/c21-13-9-4-2-1-3-8-12-17-18(20(23)15-19(17)22)14-16-10-6-5-7-11-16/h5-8,10-12,17-19,21-22H,1-4,9,13-15H2/b12-8+/t17-,18-,19+/m1/s1