2-bromanyl-2-(4-nitrophenyl)-5-oxidanylidene-3,5-diphenyl-pentanenitrile

Systemtic Name: 2-bromanyl-2-(4-nitrophenyl)-5-oxidanylidene-3,5-diphenyl-pentanenitrile Openeye Name: 2-bromo-2-(4-nitrophenyl)-5-oxo-3,5-diphenyl-pentanenitrile CAS Name: 2-bromo-2-(4-nitrophenyl)-5-oxo-3,5-diphenylpentanenitrile IUPAC Name: 2-bromo-2-(4-nitrophenyl)-5-oxo-3,5-diphenylpentanenitrile Traditional Name: 2-bromo-5-keto-2-(4-nitrophenyl)-3,5-diphenyl-valeronitrile Formula: C23H17BrN2O3 MolecularWeight: 449.29668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(C#N)(C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(C#N)(C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C23H17BrN2O3/c24-23(16-25,19-11-13-20(14-12-19)26(28)29)21(17-7-3-1-4-8-17)15-22(27)18-9-5-2-6-10-18/h1-14,21H,15H2