2-(4-sulfamoylphenyl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]azanium chloride

Systemtic Name: 2-(4-sulfamoylphenyl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]azanium chloride Openeye Name: 2-(4-sulfamoylphenyl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium chloride CAS Name: 2-(4-sulfamoylphenyl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium chloride IUPAC Name: 2-(4-sulfamoylphenyl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]azanium chloride Traditional Name: 2-(4-sulfamoylphenyl)ethyl-(2,4,5-trimethoxybenzyl)ammonium chloride Formula: C18H25ClN2O5S MolecularWeight: 416.9195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)N)OC)OC.[Cl-]

Isomeric SMILES

COC1=CC(=C(C=C1C[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)N)OC)OC.[Cl-]

InChI

InChI=1S/C18H24N2O5S.ClH/c1-23-16-11-18(25-3)17(24-2)10-14(16)12-20-9-8-13-4-6-15(7-5-13)26(19,21)22;/h4-7,10-11,20H,8-9,12H2,1-3H3,(H2,19,21,22);1H