N-[3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-2-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(4-benzhydrylpiperazin-4-ium-1-yl)-3-oxo-propyl]-2-fluoro-benzenesulfonamide CAS Name: N-[3-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-oxopropyl]-2-fluorobenzenesulfonamide IUPAC Name: N-[3-(4-benzhydrylpiperazin-4-ium-1-yl)-3-oxopropyl]-2-fluorobenzenesulfonamide Traditional Name: N-[3-(4-benzhydrylpiperazin-4-ium-1-yl)-3-keto-propyl]-2-fluoro-benzenesulfonamide Formula: C26H29FN3O3S+ MolecularWeight: 482.590163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCNS(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCNS(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C26H28FN3O3S/c27-23-13-7-8-14-24(23)34(32,33)28-16-15-25(31)29-17-19-30(20-18-29)26(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,26,28H,15-20H2/p+1