(4S)-4-[2-[(1S)-1-oxidanylethyl]phenoxy]pentan-2-one

Systemtic Name: (4S)-4-[2-[(1S)-1-oxidanylethyl]phenoxy]pentan-2-one Openeye Name: (4S)-4-[2-[(1S)-1-hydroxyethyl]phenoxy]pentan-2-one CAS Name: (4S)-4-[2-[(1S)-1-hydroxyethyl]phenoxy]-2-pentanone IUPAC Name: (4S)-4-[2-[(1S)-1-hydroxyethyl]phenoxy]pentan-2-one Traditional Name: (4S)-4-[2-[(1S)-1-hydroxyethyl]phenoxy]pentan-2-one Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C)OC1=CC=CC=C1C(C)O

Isomeric SMILES

C[C@@H](CC(=O)C)OC1=CC=CC=C1[C@H](C)O

InChI

InChI=1S/C13H18O3/c1-9(14)8-10(2)16-13-7-5-4-6-12(13)11(3)15/h4-7,10-11,15H,8H2,1-3H3/t10-,11-/m0/s1