2-[4-[[(3-ethanoylphenyl)sulfonylamino]methyl]phenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[4-[[(3-ethanoylphenyl)sulfonylamino]methyl]phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[4-[[(3-acetylphenyl)sulfonylamino]methyl]phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[4-[[(3-acetylphenyl)sulfonylamino]methyl]phenoxy]ethyl-diethylammonium IUPAC Name: 2-[4-[[(3-acetylphenyl)sulfonylamino]methyl]phenoxy]ethyl-diethylazanium Traditional Name: 2-[4-[[(3-acetylphenyl)sulfonylamino]methyl]phenoxy]ethyl-diethyl-ammonium Formula: C21H29N2O4S+ MolecularWeight: 405.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)C

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C21H28N2O4S/c1-4-23(5-2)13-14-27-20-11-9-18(10-12-20)16-22-28(25,26)21-8-6-7-19(15-21)17(3)24/h6-12,15,22H,4-5,13-14,16H2,1-3H3/p+1