dimethyl-[3-[5-nitro-2-(2-pyrrolidin-1-ylethyl)benzimidazol-1-yl]propyl]azanium chloride

Systemtic Name: dimethyl-[3-[5-nitro-2-(2-pyrrolidin-1-ylethyl)benzimidazol-1-yl]propyl]azanium chloride Openeye Name: dimethyl-[3-[5-nitro-2-(2-pyrrolidin-1-ylethyl)benzimidazol-1-yl]propyl]ammonium chloride CAS Name: dimethyl-[3-[5-nitro-2-[2-(1-pyrrolidinyl)ethyl]-1-benzimidazolyl]propyl]ammonium chloride IUPAC Name: dimethyl-[3-[5-nitro-2-(2-pyrrolidin-1-ylethyl)benzimidazol-1-yl]propyl]azanium chloride Traditional Name: dimethyl-[3-[5-nitro-2-(2-pyrrolidinoethyl)benzimidazol-1-yl]propyl]ammonium chloride Formula: C18H28ClN5O2 MolecularWeight: 381.90022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CCN3CCCC3.[Cl-]

Isomeric SMILES

C[NH+](C)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CCN3CCCC3.[Cl-]

InChI

InChI=1S/C18H27N5O2.ClH/c1-20(2)9-5-12-22-17-7-6-15(23(24)25)14-16(17)19-18(22)8-13-21-10-3-4-11-21;/h6-7,14H,3-5,8-13H2,1-2H3;1H