3-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[4-[(4-ethoxyphenyl)sulfamoyl]benzoyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[4-[(4-ethoxyphenyl)sulfamoyl]benzoyl]amino]propyl]-methylazanium Traditional Name: benzyl-methyl-[3-[[4-(p-phenetylsulfamoyl)benzoyl]amino]propyl]ammonium Formula: C26H32N3O4S+ MolecularWeight: 482.61498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C26H31N3O4S/c1-3-33-24-14-12-23(13-15-24)28-34(31,32)25-16-10-22(11-17-25)26(30)27-18-7-19-29(2)20-21-8-5-4-6-9-21/h4-6,8-17,28H,3,7,18-20H2,1-2H3,(H,27,30)/p+1