2-[1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-phenyl-propyl]propanedinitrile

Systemtic Name: 2-[1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-phenyl-propyl]propanedinitrile Openeye Name: 2-[1-(1,3-benzodioxol-5-yl)-3-oxo-3-phenyl-propyl]propanedinitrile CAS Name: 2-[1-(1,3-benzodioxol-5-yl)-3-oxo-3-phenylpropyl]propanedinitrile IUPAC Name: 2-[1-(1,3-benzodioxol-5-yl)-3-oxo-3-phenylpropyl]propanedinitrile Traditional Name: 2-[1-(1,3-benzodioxol-5-yl)-3-keto-3-phenyl-propyl]malononitrile Formula: C19H14N2O3 MolecularWeight: 318.32606

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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(C#N)C#N

Isomeric SMILES

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

InChI

InChI=1S/C19H14N2O3/c20-10-15(11-21)16(9-17(22)13-4-2-1-3-5-13)14-6-7-18-19(8-14)24-12-23-18/h1-8,15-16H,9,12H2