2-(1,3-benzodioxol-5-yl)-4-cyclohexyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-cyclohexyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-cyclohexyl-3-oxo-butanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-4-cyclohexyl-3-oxobutanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-cyclohexyl-3-oxobutanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-cyclohexyl-3-keto-butyronitrile Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)C(C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCC(CC1)CC(=O)C(C#N)C2=CC3=C(C=C2)OCO3

InChI

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