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

Systemtic Name: [2-[[3-[(4-ethanoylphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [2-[[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [2-[[[3-[(4-acetylphenyl)sulfonylamino]-1-oxopropyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [2-[[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl-diethylazanium Traditional Name: [2-[[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]methyl]benzyl]-diethyl-ammonium Formula: C23H32N3O4S+ MolecularWeight: 446.58288

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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)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O4S/c1-4-26(5-2)17-21-9-7-6-8-20(21)16-24-23(28)14-15-25-31(29,30)22-12-10-19(11-13-22)18(3)27/h6-13,25H,4-5,14-17H2,1-3H3,(H,24,28)/p+1