2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-methyl-5-oxidanylidene-pentanenitrile

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-methyl-5-oxidanylidene-pentanenitrile Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-methyl-5-oxo-pentanenitrile CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-methyl-5-oxopentanenitrile IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-methyl-5-oxopentanenitrile Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-keto-2-methyl-valeronitrile Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=O)(C#N)C1COC2=CC=CC=C2O1

Isomeric SMILES

CC(CCC=O)(C#N)C1COC2=CC=CC=C2O1

InChI

InChI=1S/C14H15NO3/c1-14(10-15,7-4-8-16)13-9-17-11-5-2-3-6-12(11)18-13/h2-3,5-6,8,13H,4,7,9H2,1H3