2-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-thiophen-2-yl-propanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-thiophen-2-yl-propanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-oxo-3-(2-thienyl)propanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-3-oxo-3-thiophen-2-ylpropanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-oxo-3-thiophen-2-ylpropanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-keto-3-(2-thienyl)propionitrile Formula: C14H9NO3S MolecularWeight: 271.29116

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C#N)C(=O)C3=CC=CS3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C#N)C(=O)C3=CC=CS3

InChI

InChI=1S/C14H9NO3S/c15-7-10(14(16)13-2-1-5-19-13)9-3-4-11-12(6-9)18-8-17-11/h1-6,10H,8H2