1-(4-nitrophenyl)sulfonyl-N-[2-(4-nitropyrazol-1-yl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-nitrophenyl)sulfonyl-N-[2-(4-nitropyrazol-1-yl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(4-nitrophenyl)sulfonyl-N-[2-(4-nitropyrazol-1-yl)ethyl]piperidine-4-carboxamide CAS Name: 1-(4-nitrophenyl)sulfonyl-N-[2-(4-nitro-1-pyrazolyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-nitrophenyl)sulfonyl-N-[2-(4-nitropyrazol-1-yl)ethyl]piperidine-4-carboxamide Traditional Name: N-[2-(4-nitropyrazol-1-yl)ethyl]-1-nosyl-isonipecotamide Formula: C17H20N6O7S MolecularWeight: 452.4417

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCN2C=C(C=N2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCCN2C=C(C=N2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N6O7S/c24-17(18-7-10-20-12-15(11-19-20)23(27)28)13-5-8-21(9-6-13)31(29,30)16-3-1-14(2-4-16)22(25)26/h1-4,11-13H,5-10H2,(H,18,24)