2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)hexanenitrile

Systemtic Name: 2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)hexanenitrile Openeye Name: 2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)hexanenitrile CAS Name: 2-(2,4-dichlorophenyl)-2-(1-imidazolylmethyl)hexanenitrile IUPAC Name: 2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)hexanenitrile Traditional Name: 2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)hexanenitrile Formula: C16H17Cl2N3 MolecularWeight: 322.23228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1C=CN=C1)(C#N)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCC(CN1C=CN=C1)(C#N)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3/c1-2-3-6-16(10-19,11-21-8-7-20-12-21)14-5-4-13(17)9-15(14)18/h4-5,7-9,12H,2-3,6,11H2,1H3