diethyl-[2-methyl-3-[(2-oxidanylidene-6-piperidin-1-ylsulfonyl-1H-quinolin-4-yl)carbonylamino]propyl]azanium

Systemtic Name: diethyl-[2-methyl-3-[(2-oxidanylidene-6-piperidin-1-ylsulfonyl-1H-quinolin-4-yl)carbonylamino]propyl]azanium Openeye Name: diethyl-[2-methyl-3-[[2-oxo-6-(1-piperidylsulfonyl)-1H-quinoline-4-carbonyl]amino]propyl]ammonium CAS Name: diethyl-[2-methyl-3-[[oxo-[2-oxo-6-(1-piperidinylsulfonyl)-1H-quinolin-4-yl]methyl]amino]propyl]ammonium IUPAC Name: diethyl-[2-methyl-3-[(2-oxo-6-piperidin-1-ylsulfonyl-1H-quinoline-4-carbonyl)amino]propyl]azanium Traditional Name: diethyl-[3-[(2-keto-6-piperidinosulfonyl-1H-quinoline-4-carbonyl)amino]-2-methyl-propyl]ammonium Formula: C23H35N4O4S+ MolecularWeight: 463.6134

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(C)CNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC[NH+](CC)CC(C)CNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H34N4O4S/c1-4-26(5-2)16-17(3)15-24-23(29)20-14-22(28)25-21-10-9-18(13-19(20)21)32(30,31)27-11-7-6-8-12-27/h9-10,13-14,17H,4-8,11-12,15-16H2,1-3H3,(H,24,29)(H,25,28)/p+1