2-(2-methylpyridin-1-ium-1-yl)-1-[2-(3-nitrophenyl)indolizin-3-yl]ethanone chloride

Systemtic Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[2-(3-nitrophenyl)indolizin-3-yl]ethanone chloride Openeye Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[2-(3-nitrophenyl)indolizin-3-yl]ethanone chloride CAS Name: 2-(2-methyl-1-pyridin-1-iumyl)-1-[2-(3-nitrophenyl)-3-indolizinyl]ethanone chloride IUPAC Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[2-(3-nitrophenyl)indolizin-3-yl]ethanone chloride Traditional Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[2-(3-nitrophenyl)indolizin-3-yl]ethanone chloride Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CC(=O)C2=C(C=C3N2C=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC1=CC=CC=[N+]1CC(=O)C2=C(C=C3N2C=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C22H18N3O3.ClH/c1-16-7-2-4-11-23(16)15-21(26)22-20(14-18-9-3-5-12-24(18)22)17-8-6-10-19(13-17)25(27)28;/h2-14H,15H2,1H3;1H/q+1;/p-1