7-(3-iodanylphenyl)-7-oxidanylidene-heptanenitrile

Systemtic Name: 7-(3-iodanylphenyl)-7-oxidanylidene-heptanenitrile Openeye Name: 7-(3-iodophenyl)-7-oxo-heptanenitrile CAS Name: 7-(3-iodophenyl)-7-oxoheptanenitrile IUPAC Name: 7-(3-iodophenyl)-7-oxoheptanenitrile Traditional Name: 7-(3-iodophenyl)-7-keto-enanthonitrile Formula: C13H14INO MolecularWeight: 327.16083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C(=O)CCCCCC#N

Isomeric SMILES

C1=CC(=CC(=C1)I)C(=O)CCCCCC#N

InChI

InChI=1S/C13H14INO/c14-12-7-5-6-11(10-12)13(16)8-3-1-2-4-9-15/h5-7,10H,1-4,8H2