2-(1,3-benzodioxol-5-yl)-5-cyclopentyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-cyclopentyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-cyclopentyl-3-oxo-pentanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-5-cyclopentyl-3-oxopentanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-cyclopentyl-3-oxopentanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-cyclopentyl-3-keto-valeronitrile Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)C(C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCC(C1)CCC(=O)C(C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19NO3/c18-10-14(15(19)7-5-12-3-1-2-4-12)13-6-8-16-17(9-13)21-11-20-16/h6,8-9,12,14H,1-5,7,11H2