2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(1-propylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(1-propylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[methyl(2-naphthylsulfonyl)amino]-N-(1-propylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[methyl(2-naphthalenylsulfonyl)amino]-N-(1-propyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(1-propylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[methyl(2-naphthylsulfonyl)amino]-N-(1-propylpiperidin-1-ium-4-yl)acetamide Formula: C21H30N3O3S+ MolecularWeight: 404.5462

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)CN(C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)CN(C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H29N3O3S/c1-3-12-24-13-10-19(11-14-24)22-21(25)16-23(2)28(26,27)20-9-8-17-6-4-5-7-18(17)15-20/h4-9,15,19H,3,10-14,16H2,1-2H3,(H,22,25)/p+1