4-chloranyl-3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 4-chloranyl-3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 4-chloro-3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 4-chloro-3-[(2,3-dimethylphenyl)sulfamoyl]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 4-chloro-3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 4-chloro-3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C21H27ClN3O4S+ MolecularWeight: 452.97478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC[NH+]3CCOCC3)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC[NH+]3CCOCC3)Cl)C

InChI

InChI=1S/C21H26ClN3O4S/c1-15-4-3-5-19(16(15)2)24-30(27,28)20-14-17(6-7-18(20)22)21(26)23-8-9-25-10-12-29-13-11-25/h3-7,14,24H,8-13H2,1-2H3,(H,23,26)/p+1