3-(1,3-benzodioxol-5-ylmethoxy)-2-methyl-propanenitrile

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethoxy)-2-methyl-propanenitrile Openeye Name: 3-(1,3-benzodioxol-5-ylmethoxy)-2-methyl-propanenitrile CAS Name: 3-(1,3-benzodioxol-5-ylmethoxy)-2-methylpropanenitrile IUPAC Name: 3-(1,3-benzodioxol-5-ylmethoxy)-2-methylpropanenitrile Traditional Name: 2-methyl-3-piperonyloxy-propionitrile Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC2=C(C=C1)OCO2)C#N

Isomeric SMILES

CC(COCC1=CC2=C(C=C1)OCO2)C#N

InChI

InChI=1S/C12H13NO3/c1-9(5-13)6-14-7-10-2-3-11-12(4-10)16-8-15-11/h2-4,9H,6-8H2,1H3