3-(3-iodanylphenyl)-2-(4-methoxyphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(3-iodanylphenyl)-2-(4-methoxyphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(3-iodophenyl)-2-(4-methoxyphenyl)-3-oxo-propanenitrile CAS Name: 3-(3-iodophenyl)-2-(4-methoxyphenyl)-3-oxopropanenitrile IUPAC Name: 3-(3-iodophenyl)-2-(4-methoxyphenyl)-3-oxopropanenitrile Traditional Name: 3-(3-iodophenyl)-3-keto-2-(4-methoxyphenyl)propionitrile Formula: C16H12INO2 MolecularWeight: 377.17645

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C#N)C(=O)C2=CC(=CC=C2)I

Isomeric SMILES

COC1=CC=C(C=C1)C(C#N)C(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C16H12INO2/c1-20-14-7-5-11(6-8-14)15(10-18)16(19)12-3-2-4-13(17)9-12/h2-9,15H,1H3