2-(1,3-benzodioxol-5-yl)hept-6-enenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)hept-6-enenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)hept-6-enenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-6-heptenenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)hept-6-enenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)hept-6-enenitrile Formula: C14H15NO2 MolecularWeight: 229.2744

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC(C#N)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

C=CCCCC(C#N)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H15NO2/c1-2-3-4-5-12(9-15)11-6-7-13-14(8-11)17-10-16-13/h2,6-8,12H,1,3-5,10H2