3-[[4-chloranyl-3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[4-chloranyl-3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[[4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[4-chloro-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]propyl-diethylazanium Traditional Name: 3-[[4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]propyl-diethyl-ammonium Formula: C21H29ClN3O4S+ MolecularWeight: 454.99066

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H28ClN3O4S/c1-4-25(5-2)14-6-13-23-21(26)16-7-12-19(22)20(15-16)30(27,28)24-17-8-10-18(29-3)11-9-17/h7-12,15,24H,4-6,13-14H2,1-3H3,(H,23,26)/p+1