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

Systemtic Name: N-butan-2-yl-1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-(4-morpholinosulfonyl-2-nitro-phenyl)-N-sec-butyl-piperidine-4-carboxamide CAS Name: N-butan-2-yl-1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-piperidinecarboxamide IUPAC Name: N-butan-2-yl-1-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(4-morpholinosulfonyl-2-nitro-phenyl)-N-sec-butyl-isonipecotamide Formula: C20H30N4O6S MolecularWeight: 454.5404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O6S/c1-3-15(2)21-20(25)16-6-8-22(9-7-16)18-5-4-17(14-19(18)24(26)27)31(28,29)23-10-12-30-13-11-23/h4-5,14-16H,3,6-13H2,1-2H3,(H,21,25)