[3-[3-(dimethylamino)propyl-methyl-amino]-3-phenyl-benzimidazol-3-ium-4-yl] carbamate

Systemtic Name: [3-[3-(dimethylamino)propyl-methyl-amino]-3-phenyl-benzimidazol-3-ium-4-yl] carbamate Openeye Name: [3-[3-(dimethylamino)propyl-methyl-amino]-3-phenyl-benzimidazol-3-ium-4-yl] carbamate CAS Name: carbamic acid [3-[3-(dimethylamino)propyl-methylamino]-3-phenyl-4-benzimidazol-3-iumyl] ester IUPAC Name: [3-[3-(dimethylamino)propyl-methylamino]-3-phenylbenzimidazol-3-ium-4-yl] carbamate Traditional Name: carbamic acid [3-[3-(dimethylamino)propyl-methyl-amino]-3-phenyl-benzimidazol-3-ium-4-yl] ester Formula: C20H26N5O2+ MolecularWeight: 368.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C)[N+]1(C=NC2=C1C(=CC=C2)OC(=O)N)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCCN(C)[N+]1(C=NC2=C1C(=CC=C2)OC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C20H25N5O2/c1-23(2)13-8-14-24(3)25(16-9-5-4-6-10-16)15-22-17-11-7-12-18(19(17)25)27-20(21)26/h4-7,9-12,15H,8,13-14H2,1-3H3,(H-,21,26)/p+1