2-(3-chlorophenyl)-2-(1H-imidazol-5-ylmethyl)-3-iodanyl-hexanenitrile

Systemtic Name: 2-(3-chlorophenyl)-2-(1H-imidazol-5-ylmethyl)-3-iodanyl-hexanenitrile Openeye Name: 2-(3-chlorophenyl)-2-(1H-imidazol-5-ylmethyl)-3-iodo-hexanenitrile CAS Name: 2-(3-chlorophenyl)-2-(1H-imidazol-5-ylmethyl)-3-iodohexanenitrile IUPAC Name: 2-(3-chlorophenyl)-2-(1H-imidazol-5-ylmethyl)-3-iodohexanenitrile Traditional Name: 2-(3-chlorophenyl)-2-(1H-imidazol-5-ylmethyl)-3-iodo-hexanenitrile Formula: C16H17ClIN3 MolecularWeight: 413.68375

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC1=CN=CN1)(C#N)C2=CC(=CC=C2)Cl)I

Isomeric SMILES

CCCC(C(CC1=CN=CN1)(C#N)C2=CC(=CC=C2)Cl)I

InChI

InChI=1S/C16H17ClIN3/c1-2-4-15(18)16(10-19,8-14-9-20-11-21-14)12-5-3-6-13(17)7-12/h3,5-7,9,11,15H,2,4,8H2,1H3,(H,20,21)