3-[(4-butylphenyl)sulfamoyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 3-[(4-butylphenyl)sulfamoyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Openeye Name: 3-[(4-butylphenyl)sulfamoyl]-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide CAS Name: 3-[(4-butylphenyl)sulfamoyl]-N-(1-propan-2-yl-4-piperidin-1-iumyl)benzamide IUPAC Name: 3-[(4-butylphenyl)sulfamoyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Traditional Name: 3-[(4-butylphenyl)sulfamoyl]-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide Formula: C25H36N3O3S+ MolecularWeight: 458.63664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C25H35N3O3S/c1-4-5-7-20-10-12-23(13-11-20)27-32(30,31)24-9-6-8-21(18-24)25(29)26-22-14-16-28(17-15-22)19(2)3/h6,8-13,18-19,22,27H,4-5,7,14-17H2,1-3H3,(H,26,29)/p+1