ethyl 1-[6-[methyl(phenylsulfonyl)amino]-3-nitro-pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-[methyl(phenylsulfonyl)amino]-3-nitro-pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-[benzenesulfonyl(methyl)amino]-3-nitro-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[6-[benzenesulfonyl(methyl)amino]-3-nitro-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-[benzenesulfonyl(methyl)amino]-3-nitropyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[6-[besyl(methyl)amino]-3-nitro-2-pyridyl]isonipecotic acid ethyl ester Formula: C20H24N4O6S MolecularWeight: 448.49276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)N(C)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)N(C)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6S/c1-3-30-20(25)15-11-13-23(14-12-15)19-17(24(26)27)9-10-18(21-19)22(2)31(28,29)16-7-5-4-6-8-16/h4-10,15H,3,11-14H2,1-2H3