(2S,3R)-3-heptyl-2-[1-(4-methylphenyl)ethenyl]cyclopentan-1-one

Systemtic Name: (2S,3R)-3-heptyl-2-[1-(4-methylphenyl)ethenyl]cyclopentan-1-one Openeye Name: (2S,3R)-3-heptyl-2-[1-(p-tolyl)vinyl]cyclopentanone CAS Name: (2S,3R)-3-heptyl-2-[1-(4-methylphenyl)ethenyl]-1-cyclopentanone IUPAC Name: (2S,3R)-3-heptyl-2-[1-(4-methylphenyl)ethenyl]cyclopentan-1-one Traditional Name: (2S,3R)-3-heptyl-2-[1-(p-tolyl)vinyl]cyclopentanone Formula: C21H30O MolecularWeight: 298.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(=O)C1C(=C)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC[C@@H]1CCC(=O)[C@@H]1C(=C)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H30O/c1-4-5-6-7-8-9-19-14-15-20(22)21(19)17(3)18-12-10-16(2)11-13-18/h10-13,19,21H,3-9,14-15H2,1-2H3/t19-,21-/m1/s1