3-[2-[[(4-aminophenyl)sulfonylamino]methyl]-4-chloranyl-phenoxy]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[[(4-aminophenyl)sulfonylamino]methyl]-4-chloranyl-phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[2-[[(4-aminophenyl)sulfonylamino]methyl]-4-chloro-phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[2-[[(4-aminophenyl)sulfonylamino]methyl]-4-chlorophenoxy]propyl-dimethylammonium IUPAC Name: 3-[2-[[(4-aminophenyl)sulfonylamino]methyl]-4-chlorophenoxy]propyl-dimethylazanium Traditional Name: 3-[4-chloro-2-[(sulfanilylamino)methyl]phenoxy]propyl-dimethyl-ammonium Formula: C18H25ClN3O3S+ MolecularWeight: 398.9274

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=C(C=C(C=C1)Cl)CNS(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

C[NH+](C)CCCOC1=C(C=C(C=C1)Cl)CNS(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C18H24ClN3O3S/c1-22(2)10-3-11-25-18-9-4-15(19)12-14(18)13-21-26(23,24)17-7-5-16(20)6-8-17/h4-9,12,21H,3,10-11,13,20H2,1-2H3/p+1