N-(1-phenylethyl)-2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanamide iodide

Systemtic Name: N-(1-phenylethyl)-2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanamide iodide Openeye Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)-N-(1-phenylethyl)acetamide iodide CAS Name: N-(1-phenylethyl)-2-[3-(phenylmethyl)-1-benzimidazol-3-iumyl]acetamide iodide IUPAC Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)-N-(1-phenylethyl)acetamide iodide Traditional Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)-N-(1-phenylethyl)acetamide iodide Formula: C24H24IN3O MolecularWeight: 497.37133

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CN2C=[N+](C3=CC=CC=C32)CC4=CC=CC=C4.[I-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CN2C=[N+](C3=CC=CC=C32)CC4=CC=CC=C4.[I-]

InChI

InChI=1S/C24H23N3O.HI/c1-19(21-12-6-3-7-13-21)25-24(28)17-27-18-26(16-20-10-4-2-5-11-20)22-14-8-9-15-23(22)27;/h2-15,18-19H,16-17H2,1H3;1H