1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-N-pyridin-3-yl-piperidine-4-carboxamide

Systemtic Name: 1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-N-pyridin-3-yl-piperidine-4-carboxamide Openeye Name: 1-(4-morpholinosulfonyl-2-nitro-phenyl)-N-(3-pyridyl)piperidine-4-carboxamide CAS Name: 1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-N-(3-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)-N-pyridin-3-ylpiperidine-4-carboxamide Traditional Name: 1-(4-morpholinosulfonyl-2-nitro-phenyl)-N-(3-pyridyl)isonipecotamide Formula: C21H25N5O6S MolecularWeight: 475.5181

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CN=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CN=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O6S/c27-21(23-17-2-1-7-22-15-17)16-5-8-24(9-6-16)19-4-3-18(14-20(19)26(28)29)33(30,31)25-10-12-32-13-11-25/h1-4,7,14-16H,5-6,8-13H2,(H,23,27)