[2-[[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [2-[[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [2-[[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [2-[[[3-[(4-ethoxyphenyl)sulfonylamino]-1-oxopropyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [2-[[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethylazanium Traditional Name: diethyl-[2-[[3-(p-phenetylsulfonylamino)propanoylamino]methyl]benzyl]ammonium Formula: C23H34N3O4S+ MolecularWeight: 448.59876

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C23H33N3O4S/c1-4-26(5-2)18-20-10-8-7-9-19(20)17-24-23(27)15-16-25-31(28,29)22-13-11-21(12-14-22)30-6-3/h7-14,25H,4-6,15-18H2,1-3H3,(H,24,27)/p+1