1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[(2-fluorophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[(2-fluorophenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[(2-fluorophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[(2-fluorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[(2-fluorophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(2-fluorobenzyl)isonipecotamide Formula: C19H19ClFN3O5S MolecularWeight: 455.887663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2F)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2F)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19ClFN3O5S/c20-16-6-5-15(24(26)27)11-18(16)30(28,29)23-9-7-13(8-10-23)19(25)22-12-14-3-1-2-4-17(14)21/h1-6,11,13H,7-10,12H2,(H,22,25)