(4-chloranyl-2-nitro-phenyl) 1-methylpyridin-1-ium-4-carboxylate

Systemtic Name: (4-chloranyl-2-nitro-phenyl) 1-methylpyridin-1-ium-4-carboxylate Openeye Name: (4-chloro-2-nitro-phenyl) 1-methylpyridin-1-ium-4-carboxylate CAS Name: 1-methyl-4-pyridin-1-iumcarboxylic acid (4-chloro-2-nitrophenyl) ester IUPAC Name: (4-chloro-2-nitrophenyl) 1-methylpyridin-1-ium-4-carboxylate Traditional Name: 1-methylpyridin-1-ium-4-carboxylic acid (4-chloro-2-nitro-phenyl) ester Formula: C13H10ClN2O4+ MolecularWeight: 293.6825

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H10ClN2O4/c1-15-6-4-9(5-7-15)13(17)20-12-3-2-10(14)8-11(12)16(18)19/h2-8H,1H3/q+1