2-(1,3-benzodioxol-5-yl)-3-methyl-butanoyl chloride

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-methyl-butanoyl chloride Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-methyl-butanoyl chloride CAS Name: 2-(1,3-benzodioxol-5-yl)-3-methylbutanoyl chloride IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-methylbutanoyl chloride Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-methyl-butyryl chloride Formula: C12H13ClO3 MolecularWeight: 240.68282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO3/c1-7(2)11(12(13)14)8-3-4-9-10(5-8)16-6-15-9/h3-5,7,11H,6H2,1-2H3