2-(3-bromophenyl)-3-(5-nitrofuran-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(3-bromophenyl)-3-(5-nitrofuran-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(3-bromophenyl)-3-(5-nitro-2-furyl)-3-oxo-propanenitrile CAS Name: 2-(3-bromophenyl)-3-(5-nitro-2-furanyl)-3-oxopropanenitrile IUPAC Name: 2-(3-bromophenyl)-3-(5-nitrofuran-2-yl)-3-oxopropanenitrile Traditional Name: 2-(3-bromophenyl)-3-keto-3-(5-nitro-2-furyl)propionitrile Formula: C13H7BrN2O4 MolecularWeight: 335.10968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(C#N)C(=O)C2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(C#N)C(=O)C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C13H7BrN2O4/c14-9-3-1-2-8(6-9)10(7-15)13(17)11-4-5-12(20-11)16(18)19/h1-6,10H