4-(3-iodanylpyridin-4-yl)-4-oxidanyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-(3-iodanylpyridin-4-yl)-4-oxidanyl-cyclohexane-1-carbonitrile Openeye Name: 4-hydroxy-4-(3-iodo-4-pyridyl)cyclohexanecarbonitrile CAS Name: 4-hydroxy-4-(3-iodo-4-pyridinyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-hydroxy-4-(3-iodopyridin-4-yl)cyclohexane-1-carbonitrile Traditional Name: 4-hydroxy-4-(3-iodo-4-pyridyl)cyclohexanecarbonitrile Formula: C12H13IN2O MolecularWeight: 328.14889

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C#N)(C2=C(C=NC=C2)I)O

Isomeric SMILES

C1CC(CCC1C#N)(C2=C(C=NC=C2)I)O

InChI

InChI=1S/C12H13IN2O/c13-11-8-15-6-3-10(11)12(16)4-1-9(7-14)2-5-12/h3,6,8-9,16H,1-2,4-5H2