(2S,3S)-3-ethyl-2-oxidanyl-heptan-4-one

Systemtic Name: (2S,3S)-3-ethyl-2-oxidanyl-heptan-4-one Openeye Name: (2S,3S)-3-ethyl-2-hydroxy-heptan-4-one CAS Name: (2S,3S)-3-ethyl-2-hydroxy-4-heptanone IUPAC Name: (2S,3S)-3-ethyl-2-hydroxyheptan-4-one Traditional Name: (2S,3S)-3-ethyl-2-hydroxy-heptan-4-one Formula: C9H18O2 MolecularWeight: 158.23802

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC)C(C)O

Isomeric SMILES

CCCC(=O)[C@@H](CC)[C@H](C)O

InChI

InChI=1S/C9H18O2/c1-4-6-9(11)8(5-2)7(3)10/h7-8,10H,4-6H2,1-3H3/t7-,8-/m0/s1