(E)-5-iodanyl-2,2-dimethyl-4-phenyl-pent-4-enenitrile

Systemtic Name: (E)-5-iodanyl-2,2-dimethyl-4-phenyl-pent-4-enenitrile Openeye Name: (E)-5-iodo-2,2-dimethyl-4-phenyl-pent-4-enenitrile CAS Name: (E)-5-iodo-2,2-dimethyl-4-phenyl-4-pentenenitrile IUPAC Name: (E)-5-iodo-2,2-dimethyl-4-phenylpent-4-enenitrile Traditional Name: (E)-5-iodo-2,2-dimethyl-4-phenyl-pent-4-enenitrile Formula: C13H14IN MolecularWeight: 311.16143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=CI)C1=CC=CC=C1)C#N

Isomeric SMILES

CC(C)(C/C(=C\I)/C1=CC=CC=C1)C#N

InChI

InChI=1S/C13H14IN/c1-13(2,10-15)8-12(9-14)11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3/b12-9+