methyl 6-(4-chlorophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate

Systemtic Name: methyl 6-(4-chlorophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate Openeye Name: methyl 6-(4-chlorophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate CAS Name: 6-[(4-chlorophenyl)thio]-5-nitro-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-chlorophenyl)sulfanyl-5-nitropyridine-3-carboxylate Traditional Name: 6-[(4-chlorophenyl)thio]-5-nitro-nicotinic acid methyl ester Formula: C13H9ClN2O4S MolecularWeight: 324.73956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H9ClN2O4S/c1-20-13(17)8-6-11(16(18)19)12(15-7-8)21-10-4-2-9(14)3-5-10/h2-7H,1H3