N-[(2R)-2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(2R)-2-(2-furyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2R)-2-(2-furanyl)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[(2R)-2-(2-furyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide Formula: C24H30N3O4S+ MolecularWeight: 456.5777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CO2)[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC[C@H](C2=CC=CO2)[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N3O4S/c1-19-5-11-22(12-6-19)32(28,29)25-18-23(24-4-3-17-31-24)27-15-13-26(14-16-27)20-7-9-21(30-2)10-8-20/h3-12,17,23,25H,13-16,18H2,1-2H3/p+1/t23-/m1/s1