N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-2-pyridin-1-ium-1-yl-ethanamide chloride

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-2-pyridin-1-ium-1-yl-ethanamide chloride Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-2-pyridin-1-ium-1-yl-acetamide chloride CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-2-(1-pyridin-1-iumyl)acetamide chloride IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-2-pyridin-1-ium-1-ylacetamide chloride Traditional Name: N-(2-chloro-5-nitro-benzyl)-N-methyl-2-pyridin-1-ium-1-yl-acetamide chloride Formula: C15H15Cl2N3O3 MolecularWeight: 356.2039

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C[N+]2=CC=CC=C2.[Cl-]

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C[N+]2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C15H15ClN3O3.ClH/c1-17(15(20)11-18-7-3-2-4-8-18)10-12-9-13(19(21)22)5-6-14(12)16;/h2-9H,10-11H2,1H3;1H/q+1;/p-1