methyl 6-(2-aminophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate

Systemtic Name: methyl 6-(2-aminophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate Openeye Name: methyl 6-(2-aminophenyl)sulfanyl-5-nitro-pyridine-3-carboxylate CAS Name: 6-[(2-aminophenyl)thio]-5-nitro-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(2-aminophenyl)sulfanyl-5-nitropyridine-3-carboxylate Traditional Name: 6-[(2-aminophenyl)thio]-5-nitro-nicotinic acid methyl ester Formula: C13H11N3O4S MolecularWeight: 305.30914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)SC2=CC=CC=C2N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)SC2=CC=CC=C2N)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O4S/c1-20-13(17)8-6-10(16(18)19)12(15-7-8)21-11-5-3-2-4-9(11)14/h2-7H,14H2,1H3