(3-ethoxy-4-phenylmethoxy-phenyl)methyl-[2-(4-sulfamoylphenyl)ethyl]azanium

Systemtic Name: (3-ethoxy-4-phenylmethoxy-phenyl)methyl-[2-(4-sulfamoylphenyl)ethyl]azanium Openeye Name: (4-benzyloxy-3-ethoxy-phenyl)methyl-[2-(4-sulfamoylphenyl)ethyl]ammonium CAS Name: (3-ethoxy-4-phenylmethoxyphenyl)methyl-[2-(4-sulfamoylphenyl)ethyl]ammonium IUPAC Name: (3-ethoxy-4-phenylmethoxyphenyl)methyl-[2-(4-sulfamoylphenyl)ethyl]azanium Traditional Name: (4-benzoxy-3-ethoxy-benzyl)-[2-(4-sulfamoylphenyl)ethyl]ammonium Formula: C24H29N2O4S+ MolecularWeight: 441.56306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)N)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)N)OCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4S/c1-2-29-24-16-21(10-13-23(24)30-18-20-6-4-3-5-7-20)17-26-15-14-19-8-11-22(12-9-19)31(25,27)28/h3-13,16,26H,2,14-15,17-18H2,1H3,(H2,25,27,28)/p+1