3-ethyl-N,N,2-trimethyl-1-phenyl-benzimidazol-3-ium-5-carboxamide iodide

Systemtic Name: 3-ethyl-N,N,2-trimethyl-1-phenyl-benzimidazol-3-ium-5-carboxamide iodide Openeye Name: 3-ethyl-N,N,2-trimethyl-1-phenyl-benzimidazol-3-ium-5-carboxamide iodide CAS Name: 3-ethyl-N,N,2-trimethyl-1-phenyl-5-benzimidazol-3-iumcarboxamide iodide IUPAC Name: 3-ethyl-N,N,2-trimethyl-1-phenylbenzimidazol-3-ium-5-carboxamide iodide Traditional Name: 3-ethyl-N,N,2-trimethyl-1-phenyl-benzimidazol-3-ium-5-carboxamide iodide Formula: C19H22IN3O MolecularWeight: 435.30195

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=C(C=C2)C(=O)N(C)C)C3=CC=CC=C3)C.[I-]

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=C(C=C2)C(=O)N(C)C)C3=CC=CC=C3)C.[I-]

InChI

InChI=1S/C19H22N3O.HI/c1-5-21-14(2)22(16-9-7-6-8-10-16)17-12-11-15(13-18(17)21)19(23)20(3)4;/h6-13H,5H2,1-4H3;1H/q+1;/p-1