(2S,3S)-3-butyl-2-(phenylmethyl)cyclohexan-1-one

Systemtic Name: (2S,3S)-3-butyl-2-(phenylmethyl)cyclohexan-1-one Openeye Name: (2S,3S)-2-benzyl-3-butyl-cyclohexanone CAS Name: (2S,3S)-3-butyl-2-(phenylmethyl)-1-cyclohexanone IUPAC Name: (2S,3S)-2-benzyl-3-butylcyclohexan-1-one Traditional Name: (2S,3S)-2-benzyl-3-butyl-cyclohexanone Formula: C17H24O MolecularWeight: 244.37186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCCC(=O)C1CC2=CC=CC=C2

Isomeric SMILES

CCCC[C@H]1CCCC(=O)[C@H]1CC2=CC=CC=C2

InChI

InChI=1S/C17H24O/c1-2-3-10-15-11-7-12-17(18)16(15)13-14-8-5-4-6-9-14/h4-6,8-9,15-16H,2-3,7,10-13H2,1H3/t15-,16-/m0/s1