2-(chloromethyl)-1-propyl-benzimidazole-5-carbonitrile hydrochloride

Systemtic Name: 2-(chloromethyl)-1-propyl-benzimidazole-5-carbonitrile hydrochloride Openeye Name: 2-(chloromethyl)-1-propyl-benzimidazole-5-carbonitrile hydrochloride CAS Name: 2-(chloromethyl)-1-propyl-5-benzimidazolecarbonitrile hydrochloride IUPAC Name: 2-(chloromethyl)-1-propylbenzimidazole-5-carbonitrile hydrochloride Traditional Name: 2-(chloromethyl)-1-propyl-benzimidazole-5-carbonitrile hydrochloride Formula: C12H13Cl2N3 MolecularWeight: 270.15772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C#N)N=C1CCl.Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C#N)N=C1CCl.Cl

InChI

InChI=1S/C12H12ClN3.ClH/c1-2-5-16-11-4-3-9(8-14)6-10(11)15-12(16)7-13;/h3-4,6H,2,5,7H2,1H3;1H