N-(4-fluoranyl-3-nitro-phenyl)-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(4-fluoro-3-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(4-fluoro-3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(4-fluoro-3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-besyl-N-(4-fluoro-3-nitro-phenyl)isonipecotamide Formula: C18H18FN3O5S MolecularWeight: 407.416023

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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=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H18FN3O5S/c19-16-7-6-14(12-17(16)22(24)25)20-18(23)13-8-10-21(11-9-13)28(26,27)15-4-2-1-3-5-15/h1-7,12-13H,8-11H2,(H,20,23)