2-methyl-3-[(E,3S)-3-phenylmethoxyoct-1-enyl]cyclopent-2-en-1-one

Systemtic Name: 2-methyl-3-[(E,3S)-3-phenylmethoxyoct-1-enyl]cyclopent-2-en-1-one Openeye Name: 3-[(E,3S)-3-benzyloxyoct-1-enyl]-2-methyl-cyclopent-2-en-1-one CAS Name: 2-methyl-3-[(E,3S)-3-phenylmethoxyoct-1-enyl]-1-cyclopent-2-enone IUPAC Name: 2-methyl-3-[(E,3S)-3-phenylmethoxyoct-1-enyl]cyclopent-2-en-1-one Traditional Name: 3-[(E,3S)-3-benzoxyoct-1-enyl]-2-methyl-cyclopent-2-en-1-one Formula: C21H28O2 MolecularWeight: 312.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1=C(C(=O)CC1)C)OCC2=CC=CC=C2

Isomeric SMILES

CCCCC[C@@H](/C=C/C1=C(C(=O)CC1)C)OCC2=CC=CC=C2

InChI

InChI=1S/C21H28O2/c1-3-4-6-11-20(23-16-18-9-7-5-8-10-18)14-12-19-13-15-21(22)17(19)2/h5,7-10,12,14,20H,3-4,6,11,13,15-16H2,1-2H3/b14-12+/t20-/m0/s1