4-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethoxy]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethoxy]-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]-N-isopropyl-benzenesulfonamide CAS Name: 4-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethoxy]-N-isopropyl-benzenesulfonamide Formula: C28H34N3O4S+ MolecularWeight: 508.65226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O4S/c1-22(2)29-36(33,34)26-15-13-25(14-16-26)35-21-27(32)30-17-19-31(20-18-30)28(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-16,22,28-29H,17-21H2,1-2H3/p+1