N-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-2-nitro-benzenesulfonamide Openeye Name: N-[2-[4-(4-fluorobenzoyl)-1-piperidyl]ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]ethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-2-nitrobenzenesulfonamide Traditional Name: N-[2-[4-(4-fluorobenzoyl)piperidino]ethyl]-2-nitro-benzenesulfonamide Formula: C20H22FN3O5S MolecularWeight: 435.469183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN3O5S/c21-17-7-5-15(6-8-17)20(25)16-9-12-23(13-10-16)14-11-22-30(28,29)19-4-2-1-3-18(19)24(26)27/h1-8,16,22H,9-14H2