3-(1,3-benzodioxol-5-yl)-3-methoxy-butan-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-methoxy-butan-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-methoxy-butan-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-3-methoxy-2-butanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-methoxybutan-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-methoxy-butan-2-one Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C1=CC2=C(C=C1)OCO2)OC

Isomeric SMILES

CC(=O)C(C)(C1=CC2=C(C=C1)OCO2)OC

InChI

InChI=1S/C12H14O4/c1-8(13)12(2,14-3)9-4-5-10-11(6-9)16-7-15-10/h4-6H,7H2,1-3H3