4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Openeye Name: 4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide CAS Name: 4-[(4-ethoxyphenyl)sulfamoyl]-N-[3-(1-piperidin-1-iumyl)propyl]benzamide IUPAC Name: 4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Traditional Name: N-(3-piperidin-1-ium-1-ylpropyl)-4-(p-phenetylsulfamoyl)benzamide Formula: C23H32N3O4S+ MolecularWeight: 446.58288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCCCC3

InChI

InChI=1S/C23H31N3O4S/c1-2-30-21-11-9-20(10-12-21)25-31(28,29)22-13-7-19(8-14-22)23(27)24-15-6-18-26-16-4-3-5-17-26/h7-14,25H,2-6,15-18H2,1H3,(H,24,27)/p+1