(2S)-2-bromanyl-1-(3,4-dimethoxyphenyl)pentan-1-one

Systemtic Name: (2S)-2-bromanyl-1-(3,4-dimethoxyphenyl)pentan-1-one Openeye Name: (2S)-2-bromo-1-(3,4-dimethoxyphenyl)pentan-1-one CAS Name: (2S)-2-bromo-1-(3,4-dimethoxyphenyl)-1-pentanone IUPAC Name: (2S)-2-bromo-1-(3,4-dimethoxyphenyl)pentan-1-one Traditional Name: (2S)-2-bromo-1-(3,4-dimethoxyphenyl)pentan-1-one Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=CC(=C(C=C1)OC)OC)Br

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrO3/c1-4-5-10(14)13(15)9-6-7-11(16-2)12(8-9)17-3/h6-8,10H,4-5H2,1-3H3/t10-/m0/s1