3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide Openeye Name: 3-(1-piperidylsulfonyl)-N-(1-propylpiperidin-1-ium-4-yl)benzamide CAS Name: 3-(1-piperidinylsulfonyl)-N-(1-propyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide Traditional Name: 3-piperidinosulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-2-11-22-14-9-18(10-15-22)21-20(24)17-7-6-8-19(16-17)27(25,26)23-12-4-3-5-13-23/h6-8,16,18H,2-5,9-15H2,1H3,(H,21,24)/p+1