3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C23H32N3O4S+ MolecularWeight: 446.58288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O4S/c1-17-5-8-21(19(3)15-17)25-31(28,29)22-16-20(7-6-18(22)2)23(27)24-9-4-10-26-11-13-30-14-12-26/h5-8,15-16,25H,4,9-14H2,1-3H3,(H,24,27)/p+1