2-(1,3-benzodioxol-5-yl)-3-oxidanylidene-decanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-oxidanylidene-decanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-oxo-decanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-3-oxodecanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-oxodecanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-keto-capronitrile Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C(C#N)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCCCC(=O)C(C#N)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H21NO3/c1-2-3-4-5-6-7-15(19)14(11-18)13-8-9-16-17(10-13)21-12-20-16/h8-10,14H,2-7,12H2,1H3