N-[(2,5-dimethoxyphenyl)methyl]-4-methoxy-N-(2-morpholin-4-ium-4-ylethyl)benzenesulfonamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methoxy-N-(2-morpholin-4-ium-4-ylethyl)benzenesulfonamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methoxy-N-(2-morpholin-4-ium-4-ylethyl)benzenesulfonamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methoxy-N-[2-(4-morpholin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methoxy-N-(2-morpholin-4-ium-4-ylethyl)benzenesulfonamide Traditional Name: N-(2,5-dimethoxybenzyl)-4-methoxy-N-(2-morpholin-4-ium-4-ylethyl)benzenesulfonamide Formula: C22H31N2O6S+ MolecularWeight: 451.55634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC[NH+]2CCOCC2)CC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC[NH+]2CCOCC2)CC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C22H30N2O6S/c1-27-19-4-7-21(8-5-19)31(25,26)24(11-10-23-12-14-30-15-13-23)17-18-16-20(28-2)6-9-22(18)29-3/h4-9,16H,10-15,17H2,1-3H3/p+1