[1-[(8-ethyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)carbonyl]piperidin-4-yl]-methyl-phenethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [1-[(8-ethyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)carbonyl]piperidin-4-yl]-methyl-phenethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [1-(8-ethyl-2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)-4-piperidyl]-methyl-phenethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: [1-[(8-ethyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)-oxomethyl]-4-piperidinyl]-methyl-phenethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: [1-(8-ethyl-2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)piperidin-4-yl]-methyl-phenethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: [1-(8-ethyl-2-keto-3,4-dihydro-1H-quinoline-6-carbonyl)-4-piperidyl]-methyl-phenethyl-ammonium binoxalate Formula: C28H35N3O6 MolecularWeight: 509.594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C1NC(=O)CC2)C(=O)N3CCC(CC3)[NH+](C)CCC4=CC=CC=C4.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCC1=CC(=CC2=C1NC(=O)CC2)C(=O)N3CCC(CC3)[NH+](C)CCC4=CC=CC=C4.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C26H33N3O2.C2H2O4/c1-3-20-17-22(18-21-9-10-24(30)27-25(20)21)26(31)29-15-12-23(13-16-29)28(2)14-11-19-7-5-4-6-8-19;3-1(4)2(5)6/h4-8,17-18,23H,3,9-16H2,1-2H3,(H,27,30);(H,3,4)(H,5,6)