N-(furan-2-ylmethyl)-4-methyl-N-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-4-methyl-N-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide Openeye Name: N-(2-furylmethyl)-4-methyl-N-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide CAS Name: N-(2-furanylmethyl)-4-methyl-N-[2-oxo-2-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]ethyl]benzenesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-4-methyl-N-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide Traditional Name: N-(2-furfuryl)-N-[2-keto-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide Formula: C26H32N3O5S+ MolecularWeight: 498.61438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)N3CC[NH+](CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)N3CC[NH+](CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O5S/c1-22-9-11-25(12-10-22)35(31,32)29(20-24-8-5-18-33-24)21-26(30)28-15-13-27(14-16-28)17-19-34-23-6-3-2-4-7-23/h2-12,18H,13-17,19-21H2,1H3/p+1