6-(4-iodophenyl)-6-oxidanylidene-hexanenitrile

Systemtic Name: 6-(4-iodophenyl)-6-oxidanylidene-hexanenitrile Openeye Name: 6-(4-iodophenyl)-6-oxo-hexanenitrile CAS Name: 6-(4-iodophenyl)-6-oxohexanenitrile IUPAC Name: 6-(4-iodophenyl)-6-oxohexanenitrile Traditional Name: 6-(4-iodophenyl)-6-keto-hexanenitrile Formula: C12H12INO MolecularWeight: 313.13425

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCCC#N)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCCC#N)I

InChI

InChI=1S/C12H12INO/c13-11-7-5-10(6-8-11)12(15)4-2-1-3-9-14/h5-8H,1-4H2