4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzamide

Systemtic Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzamide Openeye Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzamide CAS Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-[2-methyl-2-(1-piperidin-1-iumyl)propyl]benzamide IUPAC Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-methyl-2-piperidin-1-ium-1-ylpropyl)benzamide Traditional Name: 4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)benzamide Formula: C25H34N3O3S+ MolecularWeight: 456.62076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC3=CC=CC=C32)[NH+]4CCCCC4

Isomeric SMILES

CC(C)(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC3=CC=CC=C32)[NH+]4CCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-25(2,27-16-6-3-7-17-27)19-26-24(29)21-12-14-22(15-13-21)32(30,31)28-18-8-10-20-9-4-5-11-23(20)28/h4-5,9,11-15H,3,6-8,10,16-19H2,1-2H3,(H,26,29)/p+1