1-[3-(tert-butylamino)-2-phenyl-imidazo[1,2-a]pyrazin-4-ium-1-yl]ethanone chloride

Systemtic Name: 1-[3-(tert-butylamino)-2-phenyl-imidazo[1,2-a]pyrazin-4-ium-1-yl]ethanone chloride Openeye Name: 1-[3-(tert-butylamino)-2-phenyl-imidazo[1,2-a]pyrazin-4-ium-1-yl]ethanone chloride CAS Name: 1-[3-(tert-butylamino)-2-phenyl-1-imidazo[1,2-a]pyrazin-4-iumyl]ethanone chloride IUPAC Name: 1-[3-(tert-butylamino)-2-phenylimidazo[1,2-a]pyrazin-4-ium-1-yl]ethanone chloride Traditional Name: 1-[3-(tert-butylamino)-2-phenyl-imidazo[1,2-a]pyrazin-4-ium-1-yl]ethanone chloride Formula: C18H21ClN4O MolecularWeight: 344.83854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=[N+](C=CN=C2)C(=C1C3=CC=CC=C3)NC(C)(C)C.[Cl-]

Isomeric SMILES

CC(=O)N1C2=[N+](C=CN=C2)C(=C1C3=CC=CC=C3)NC(C)(C)C.[Cl-]

InChI

InChI=1S/C18H21N4O.ClH/c1-13(23)22-15-12-19-10-11-21(15)17(20-18(2,3)4)16(22)14-8-6-5-7-9-14;/h5-12,20H,1-4H3;1H/q+1;/p-1