(4S,5R)-5,6-dimethyl-4-(phenylmethyl)heptan-2-one

Systemtic Name: (4S,5R)-5,6-dimethyl-4-(phenylmethyl)heptan-2-one Openeye Name: (4S,5R)-4-benzyl-5,6-dimethyl-heptan-2-one CAS Name: (4S,5R)-5,6-dimethyl-4-(phenylmethyl)-2-heptanone IUPAC Name: (4S,5R)-4-benzyl-5,6-dimethylheptan-2-one Traditional Name: (4S,5R)-4-benzyl-5,6-dimethyl-heptan-2-one Formula: C16H24O MolecularWeight: 232.36116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)C(CC1=CC=CC=C1)CC(=O)C

Isomeric SMILES

C[C@@H]([C@@H](CC1=CC=CC=C1)CC(=O)C)C(C)C

InChI

InChI=1S/C16H24O/c1-12(2)14(4)16(10-13(3)17)11-15-8-6-5-7-9-15/h5-9,12,14,16H,10-11H2,1-4H3/t14-,16-/m1/s1