methyl 6-[2,6-bis(chloranyl)phenyl]sulfanyl-5-nitro-pyridine-3-carboxylate

Systemtic Name: methyl 6-[2,6-bis(chloranyl)phenyl]sulfanyl-5-nitro-pyridine-3-carboxylate Openeye Name: methyl 6-(2,6-dichlorophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate CAS Name: 6-[(2,6-dichlorophenyl)thio]-5-nitro-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(2,6-dichlorophenyl)sulfanyl-5-nitropyridine-3-carboxylate Traditional Name: 6-[(2,6-dichlorophenyl)thio]-5-nitro-nicotinic acid methyl ester Formula: C13H8Cl2N2O4S MolecularWeight: 359.18462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)SC2=C(C=CC=C2Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)SC2=C(C=CC=C2Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H8Cl2N2O4S/c1-21-13(18)7-5-10(17(19)20)12(16-6-7)22-11-8(14)3-2-4-9(11)15/h2-6H,1H3