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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-(3-bromophenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-(3-bromophenyl)-3-oxo-propanenitrile CAS Name: 3-(1,3-benzodioxol-5-yl)-2-(3-bromophenyl)-3-oxopropanenitrile IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-(3-bromophenyl)-3-oxopropanenitrile Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-(3-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(=O)C(C#N)C3=CC(=CC=C3)Br

Isomeric SMILES

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

InChI

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