2-[(2,4-dichlorophenyl)-imidazol-1-yl-methyl]hept-6-ynenitrile

Systemtic Name: 2-[(2,4-dichlorophenyl)-imidazol-1-yl-methyl]hept-6-ynenitrile Openeye Name: 2-[(2,4-dichlorophenyl)-imidazol-1-yl-methyl]hept-6-ynenitrile CAS Name: 2-[(2,4-dichlorophenyl)-(1-imidazolyl)methyl]-6-heptynenitrile IUPAC Name: 2-[(2,4-dichlorophenyl)-imidazol-1-ylmethyl]hept-6-ynenitrile Traditional Name: 2-[(2,4-dichlorophenyl)-imidazol-1-yl-methyl]hept-6-ynenitrile Formula: C17H15Cl2N3 MolecularWeight: 332.2271

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCCCC(C#N)C(C1=C(C=C(C=C1)Cl)Cl)N2C=CN=C2

Isomeric SMILES

C#CCCCC(C#N)C(C1=C(C=C(C=C1)Cl)Cl)N2C=CN=C2

InChI

InChI=1S/C17H15Cl2N3/c1-2-3-4-5-13(11-20)17(22-9-8-21-12-22)15-7-6-14(18)10-16(15)19/h1,6-10,12-13,17H,3-5H2