methyl-[1-(7-oxidanyl-2-oxidanylidene-3,4-dihydroquinolin-1-yl)propan-2-yl]-phenethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: methyl-[1-(7-oxidanyl-2-oxidanylidene-3,4-dihydroquinolin-1-yl)propan-2-yl]-phenethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; [2-(7-hydroxy-2-oxo-3,4-dihydroquinolin-1-yl)-1-methyl-ethyl]-methyl-phenethyl-ammonium CAS Name: 2-hydroxy-2-oxoacetate; 1-(7-hydroxy-2-oxo-3,4-dihydroquinolin-1-yl)propan-2-yl-methyl-phenethylammonium IUPAC Name: 2-hydroxy-2-oxoacetate; 1-(7-hydroxy-2-oxo-3,4-dihydroquinolin-1-yl)propan-2-yl-methyl-phenethylazanium Traditional Name: [2-(7-hydroxy-2-keto-3,4-dihydroquinolin-1-yl)-1-methyl-ethyl]-methyl-phenethyl-ammonium binoxalate Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)CCC2=C1C=C(C=C2)O)[NH+](C)CCC3=CC=CC=C3.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC(CN1C(=O)CCC2=C1C=C(C=C2)O)[NH+](C)CCC3=CC=CC=C3.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C21H26N2O2.C2H2O4/c1-16(22(2)13-12-17-6-4-3-5-7-17)15-23-20-14-19(24)10-8-18(20)9-11-21(23)25;3-1(4)2(5)6/h3-8,10,14,16,24H,9,11-13,15H2,1-2H3;(H,3,4)(H,5,6)