2-(6-propyl-1,3-benzodioxol-5-yl)ethanenitrile

Systemtic Name: 2-(6-propyl-1,3-benzodioxol-5-yl)ethanenitrile Openeye Name: 2-(6-propyl-1,3-benzodioxol-5-yl)acetonitrile CAS Name: 2-(6-propyl-1,3-benzodioxol-5-yl)acetonitrile IUPAC Name: 2-(6-propyl-1,3-benzodioxol-5-yl)acetonitrile Traditional Name: 2-(6-propyl-1,3-benzodioxol-5-yl)acetonitrile Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1CC#N)OCO2

Isomeric SMILES

CCCC1=CC2=C(C=C1CC#N)OCO2

InChI

InChI=1S/C12H13NO2/c1-2-3-9-6-11-12(15-8-14-11)7-10(9)4-5-13/h6-7H,2-4,8H2,1H3