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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-(2-bromophenyl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-(2-bromophenyl)-3-oxo-propanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-3-(2-bromophenyl)-3-oxopropanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-(2-bromophenyl)-3-oxopropanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-(2-bromophenyl)-3-keto-propionitrile Formula: C16H10BrNO3 MolecularWeight: 344.1595

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C#N)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C#N)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C16H10BrNO3/c17-13-4-2-1-3-11(13)16(19)12(8-18)10-5-6-14-15(7-10)21-9-20-14/h1-7,12H,9H2