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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-4-phenyl-butanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-oxo-4-phenyl-butanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-4-oxo-4-phenylbutanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-oxo-4-phenylbutanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-keto-4-phenyl-butyronitrile Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CC(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H13NO3/c18-10-14(8-15(19)12-4-2-1-3-5-12)13-6-7-16-17(9-13)21-11-20-16/h1-7,9,14H,8,11H2