1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)isonipecotamide Formula: C16H22N4O5S MolecularWeight: 382.43468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O5S/c17-16(21)12-5-9-18(10-6-12)14-4-3-13(11-15(14)20(22)23)26(24,25)19-7-1-2-8-19/h3-4,11-12H,1-2,5-10H2,(H2,17,21)