3-(3,4-dimethoxyphenyl)oxan-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)oxan-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)tetrahydropyran-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-4-oxanone IUPAC Name: 3-(3,4-dimethoxyphenyl)oxan-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)tetrahydropyran-4-one Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2COCCC2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2COCCC2=O)OC

InChI

InChI=1S/C13H16O4/c1-15-12-4-3-9(7-13(12)16-2)10-8-17-6-5-11(10)14/h3-4,7,10H,5-6,8H2,1-2H3