2-(2-azanyl-3-methyl-pyridin-1-ium-1-yl)-1-(4-iodanyl-3-nitro-phenyl)ethanone

Systemtic Name: 2-(2-azanyl-3-methyl-pyridin-1-ium-1-yl)-1-(4-iodanyl-3-nitro-phenyl)ethanone Openeye Name: 2-(2-amino-3-methyl-pyridin-1-ium-1-yl)-1-(4-iodo-3-nitro-phenyl)ethanone CAS Name: 2-(2-amino-3-methyl-1-pyridin-1-iumyl)-1-(4-iodo-3-nitrophenyl)ethanone IUPAC Name: 2-(2-amino-3-methylpyridin-1-ium-1-yl)-1-(4-iodo-3-nitrophenyl)ethanone Traditional Name: 2-(2-amino-3-methyl-pyridin-1-ium-1-yl)-1-(4-iodo-3-nitro-phenyl)ethanone Formula: C14H13IN3O3+ MolecularWeight: 398.17579

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CC=C1)CC(=O)C2=CC(=C(C=C2)I)[N+](=O)[O-])N

Isomeric SMILES

CC1=C([N+](=CC=C1)CC(=O)C2=CC(=C(C=C2)I)[N+](=O)[O-])N

InChI

InChI=1S/C14H12IN3O3/c1-9-3-2-6-17(14(9)16)8-13(19)10-4-5-11(15)12(7-10)18(20)21/h2-7,16H,8H2,1H3/p+1