1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N-(4-fluorobenzyl)isonipecotamide Formula: C19H19ClFN3O5S MolecularWeight: 455.887663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

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