diethyl-[(2S)-2-methyl-3-[[6-[(3R)-3-methylpiperidin-1-yl]sulfonyl-2-oxidanylidene-1H-quinolin-4-yl]carbonylamino]propyl]azanium

Systemtic Name: diethyl-[(2S)-2-methyl-3-[[6-[(3R)-3-methylpiperidin-1-yl]sulfonyl-2-oxidanylidene-1H-quinolin-4-yl]carbonylamino]propyl]azanium Openeye Name: diethyl-[(2S)-2-methyl-3-[[6-[[(3R)-3-methyl-1-piperidyl]sulfonyl]-2-oxo-1H-quinoline-4-carbonyl]amino]propyl]ammonium CAS Name: diethyl-[(2S)-2-methyl-3-[[[6-[[(3R)-3-methyl-1-piperidinyl]sulfonyl]-2-oxo-1H-quinolin-4-yl]-oxomethyl]amino]propyl]ammonium IUPAC Name: diethyl-[(2S)-2-methyl-3-[[6-[(3R)-3-methylpiperidin-1-yl]sulfonyl-2-oxo-1H-quinoline-4-carbonyl]amino]propyl]azanium Traditional Name: diethyl-[(2S)-3-[[2-keto-6-[(3R)-3-methylpiperidino]sulfonyl-1H-quinoline-4-carbonyl]amino]-2-methyl-propyl]ammonium Formula: C24H37N4O4S+ MolecularWeight: 477.63998

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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)N3CCCC(C3)C

Isomeric SMILES

CC[NH+](CC)C[C@@H](C)CNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCC[C@H](C3)C

InChI

InChI=1S/C24H36N4O4S/c1-5-27(6-2)15-18(4)14-25-24(30)21-13-23(29)26-22-10-9-19(12-20(21)22)33(31,32)28-11-7-8-17(3)16-28/h9-10,12-13,17-18H,5-8,11,14-16H2,1-4H3,(H,25,30)(H,26,29)/p+1/t17-,18+/m1/s1