(4S,5R)-4,6,6-trimethyl-5-oxidanyl-heptan-3-one

Systemtic Name: (4S,5R)-4,6,6-trimethyl-5-oxidanyl-heptan-3-one Openeye Name: (4S,5R)-5-hydroxy-4,6,6-trimethyl-heptan-3-one CAS Name: (4S,5R)-5-hydroxy-4,6,6-trimethyl-3-heptanone IUPAC Name: (4S,5R)-5-hydroxy-4,6,6-trimethylheptan-3-one Traditional Name: (4S,5R)-5-hydroxy-4,6,6-trimethyl-heptan-3-one Formula: C10H20O2 MolecularWeight: 172.2646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)C(C(C)(C)C)O

Isomeric SMILES

CCC(=O)[C@@H](C)[C@H](C(C)(C)C)O

InChI

InChI=1S/C10H20O2/c1-6-8(11)7(2)9(12)10(3,4)5/h7,9,12H,6H2,1-5H3/t7-,9-/m1/s1