(2R,3S)-3-hex-1-ynyl-2-phenyl-cyclohexan-1-one

Systemtic Name: (2R,3S)-3-hex-1-ynyl-2-phenyl-cyclohexan-1-one Openeye Name: (2R,3S)-3-hex-1-ynyl-2-phenyl-cyclohexanone CAS Name: (2R,3S)-3-hex-1-ynyl-2-phenyl-1-cyclohexanone IUPAC Name: (2R,3S)-3-hex-1-ynyl-2-phenylcyclohexan-1-one Traditional Name: (2R,3S)-3-hex-1-ynyl-2-phenyl-cyclohexanone Formula: C18H22O MolecularWeight: 254.36668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1CCCC(=O)C1C2=CC=CC=C2

Isomeric SMILES

CCCCC#C[C@H]1CCCC(=O)[C@H]1C2=CC=CC=C2

InChI

InChI=1S/C18H22O/c1-2-3-4-6-10-16-13-9-14-17(19)18(16)15-11-7-5-8-12-15/h5,7-8,11-12,16,18H,2-4,9,13-14H2,1H3/t16-,18-/m0/s1