1-(2-chloranylpyridin-3-yl)sulfonyl-N-(4-fluoranyl-3-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranylpyridin-3-yl)sulfonyl-N-(4-fluoranyl-3-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-3-pyridyl)sulfonyl]-N-(4-fluoro-3-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-3-pyridinyl)sulfonyl]-N-(4-fluoro-3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-chloropyridin-3-yl)sulfonyl-N-(4-fluoro-3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-[(2-chloro-3-pyridyl)sulfonyl]-N-(4-fluoro-3-nitro-phenyl)isonipecotamide Formula: C17H16ClFN4O5S MolecularWeight: 442.849143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClFN4O5S/c18-16-15(2-1-7-20-16)29(27,28)22-8-5-11(6-9-22)17(24)21-12-3-4-13(19)14(10-12)23(25)26/h1-4,7,10-11H,5-6,8-9H2,(H,21,24)