4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonylpiperidine-1-sulfonamide

Systemtic Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonylpiperidine-1-sulfonamide Openeye Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]piperidine-1-sulfonamide CAS Name: 4-[[4-[bis(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-1-piperidinesulfonamide IUPAC Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]piperidine-1-sulfonamide Traditional Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]piperidine-1-sulfonamide Formula: C23H29F2N4O3S+ MolecularWeight: 479.563166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)S(=O)(=O)N

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)S(=O)(=O)N

InChI

InChI=1S/C23H28F2N4O3S/c24-20-5-1-17(2-6-20)22(18-3-7-21(25)8-4-18)27-13-15-28(16-14-27)23(30)19-9-11-29(12-10-19)33(26,31)32/h1-8,19,22H,9-16H2,(H2,26,31,32)/p+1