2-(7-oxidanylheptyl)-3-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]cyclopentan-1-one

Systemtic Name: 2-(7-oxidanylheptyl)-3-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]cyclopentan-1-one Openeye Name: 2-(7-hydroxyheptyl)-3-[(E)-3-oxo-3-phenyl-prop-1-enyl]cyclopentanone CAS Name: 2-(7-hydroxyheptyl)-3-[(E)-3-oxo-3-phenylprop-1-enyl]-1-cyclopentanone IUPAC Name: 2-(7-hydroxyheptyl)-3-[(E)-3-oxo-3-phenylprop-1-enyl]cyclopentan-1-one Traditional Name: 2-(7-hydroxyheptyl)-3-[(E)-3-keto-3-phenyl-prop-1-enyl]cyclopentanone Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1C=CC(=O)C2=CC=CC=C2)CCCCCCCO

Isomeric SMILES

C1CC(=O)C(C1/C=C/C(=O)C2=CC=CC=C2)CCCCCCCO

InChI

InChI=1S/C21H28O3/c22-16-8-3-1-2-7-11-19-17(13-15-21(19)24)12-14-20(23)18-9-5-4-6-10-18/h4-6,9-10,12,14,17,19,22H,1-3,7-8,11,13,15-16H2/b14-12+