N-(2-chloranyl-4-nitro-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide chloride

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide chloride Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide chloride CAS Name: N-(2-chloro-4-nitrophenyl)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]acetamide chloride IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide chloride Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide chloride Formula: C15H16Cl2N4O3 MolecularWeight: 371.21854

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.[Cl-]

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.[Cl-]

InChI

InChI=1S/C15H15ClN4O3.ClH/c1-18(2)11-5-7-19(8-6-11)10-15(21)17-14-4-3-12(20(22)23)9-13(14)16;/h3-9H,10H2,1-2H3;1H