methyl 1-(2,4-dinitrophenyl)sulfonyl-3,6-dihydro-2H-pyridine-2-carboxylate

Systemtic Name: methyl 1-(2,4-dinitrophenyl)sulfonyl-3,6-dihydro-2H-pyridine-2-carboxylate Openeye Name: methyl 1-(2,4-dinitrophenyl)sulfonyl-3,6-dihydro-2H-pyridine-2-carboxylate CAS Name: 1-(2,4-dinitrophenyl)sulfonyl-3,6-dihydro-2H-pyridine-2-carboxylic acid methyl ester IUPAC Name: methyl 1-(2,4-dinitrophenyl)sulfonyl-3,6-dihydro-2H-pyridine-2-carboxylate Traditional Name: 1-(2,4-dinitrophenyl)sulfonyl-3,6-dihydro-2H-pyridine-2-carboxylic acid methyl ester Formula: C13H13N3O8S MolecularWeight: 371.32262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CCN1S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CC=CCN1S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O8S/c1-24-13(17)10-4-2-3-7-14(10)25(22,23)12-6-5-9(15(18)19)8-11(12)16(20)21/h2-3,5-6,8,10H,4,7H2,1H3