2-(3-bromophenyl)-4-(2-nitrophenyl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(3-bromophenyl)-4-(2-nitrophenyl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(3-bromophenyl)-4-(2-nitrophenyl)-3-oxo-butanenitrile CAS Name: 2-(3-bromophenyl)-4-(2-nitrophenyl)-3-oxobutanenitrile IUPAC Name: 2-(3-bromophenyl)-4-(2-nitrophenyl)-3-oxobutanenitrile Traditional Name: 2-(3-bromophenyl)-3-keto-4-(2-nitrophenyl)butyronitrile Formula: C16H11BrN2O3 MolecularWeight: 359.17414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrN2O3/c17-13-6-3-5-11(8-13)14(10-18)16(20)9-12-4-1-2-7-15(12)19(21)22/h1-8,14H,9H2