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

Systemtic Name: 2-(3-iodanylphenyl)-4-(3-nitrophenyl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(3-iodophenyl)-4-(3-nitrophenyl)-3-oxo-butanenitrile CAS Name: 2-(3-iodophenyl)-4-(3-nitrophenyl)-3-oxobutanenitrile IUPAC Name: 2-(3-iodophenyl)-4-(3-nitrophenyl)-3-oxobutanenitrile Traditional Name: 2-(3-iodophenyl)-3-keto-4-(3-nitrophenyl)butyronitrile Formula: C16H11IN2O3 MolecularWeight: 406.17461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11IN2O3/c17-13-5-2-4-12(9-13)15(10-18)16(20)8-11-3-1-6-14(7-11)19(21)22/h1-7,9,15H,8H2