1-[2,5-bis(chloranyl)phenyl]sulfonyl-N-(4-fluoranyl-3-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]sulfonyl-N-(4-fluoranyl-3-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(4-fluoro-3-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(4-fluoro-3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(4-fluoro-3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(4-fluoro-3-nitro-phenyl)isonipecotamide Formula: C18H16Cl2FN3O5S MolecularWeight: 476.306143

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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(C=CC(=C3)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H16Cl2FN3O5S/c19-12-1-3-14(20)17(9-12)30(28,29)23-7-5-11(6-8-23)18(25)22-13-2-4-15(21)16(10-13)24(26)27/h1-4,9-11H,5-8H2,(H,22,25)