N-(furan-2-ylmethyl)-4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(2-furylmethyl)-4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide CAS Name: N-(2-furanylmethyl)-4-[[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide Traditional Name: N-(2-furfuryl)-4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide Formula: C25H30N3O6S+ MolecularWeight: 500.5872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

Isomeric SMILES

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

InChI

InChI=1S/C25H29N3O6S/c1-32-21-6-8-22(9-7-21)34-18-16-27-12-14-28(15-13-27)25(29)20-4-10-24(11-5-20)35(30,31)26-19-23-3-2-17-33-23/h2-11,17,26H,12-16,18-19H2,1H3/p+1