1-[3,6-dimethoxy-2-(3-oxidanylpropyl)phenyl]ethanone

Systemtic Name: 1-[3,6-dimethoxy-2-(3-oxidanylpropyl)phenyl]ethanone Openeye Name: 1-[2-(3-hydroxypropyl)-3,6-dimethoxy-phenyl]ethanone CAS Name: 1-[2-(3-hydroxypropyl)-3,6-dimethoxyphenyl]ethanone IUPAC Name: 1-[2-(3-hydroxypropyl)-3,6-dimethoxyphenyl]ethanone Traditional Name: 1-[2-(3-hydroxypropyl)-3,6-dimethoxy-phenyl]ethanone Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1CCCO)OC)OC

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1CCCO)OC)OC

InChI

InChI=1S/C13H18O4/c1-9(15)13-10(5-4-8-14)11(16-2)6-7-12(13)17-3/h6-7,14H,4-5,8H2,1-3H3