(2S)-1-(2,5-dimethoxyphenyl)-2-oxidanyl-heptan-1-one

Systemtic Name: (2S)-1-(2,5-dimethoxyphenyl)-2-oxidanyl-heptan-1-one Openeye Name: (2S)-1-(2,5-dimethoxyphenyl)-2-hydroxy-heptan-1-one CAS Name: (2S)-1-(2,5-dimethoxyphenyl)-2-hydroxy-1-heptanone IUPAC Name: (2S)-1-(2,5-dimethoxyphenyl)-2-hydroxyheptan-1-one Traditional Name: (2S)-1-(2,5-dimethoxyphenyl)-2-hydroxy-heptan-1-one Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C1=C(C=CC(=C1)OC)OC)O

Isomeric SMILES

CCCCC[C@@H](C(=O)C1=C(C=CC(=C1)OC)OC)O

InChI

InChI=1S/C15H22O4/c1-4-5-6-7-13(16)15(17)12-10-11(18-2)8-9-14(12)19-3/h8-10,13,16H,4-7H2,1-3H3/t13-/m0/s1