N-[2-[bis(fluoranyl)methoxy]phenyl]-3-nitro-4-(3-oxidanylpiperidin-1-yl)benzenesulfonamide

Systemtic Name: N-[2-[bis(fluoranyl)methoxy]phenyl]-3-nitro-4-(3-oxidanylpiperidin-1-yl)benzenesulfonamide Openeye Name: N-[2-(difluoromethoxy)phenyl]-4-(3-hydroxy-1-piperidyl)-3-nitro-benzenesulfonamide CAS Name: N-[2-(difluoromethoxy)phenyl]-4-(3-hydroxy-1-piperidinyl)-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(difluoromethoxy)phenyl]-4-(3-hydroxypiperidin-1-yl)-3-nitrobenzenesulfonamide Traditional Name: N-[2-(difluoromethoxy)phenyl]-4-(3-hydroxypiperidino)-3-nitro-benzenesulfonamide Formula: C18H19F2N3O6S MolecularWeight: 443.421766

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC(F)F)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C18H19F2N3O6S/c19-18(20)29-17-6-2-1-5-14(17)21-30(27,28)13-7-8-15(16(10-13)23(25)26)22-9-3-4-12(24)11-22/h1-2,5-8,10,12,18,21,24H,3-4,9,11H2