2-[[3-(2,2-dimethyloxan-4-yl)-4-phenyl-butyl]amino]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[3-(2,2-dimethyloxan-4-yl)-4-phenyl-butyl]amino]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[[3-(2,2-dimethyltetrahydropyran-4-yl)-4-phenyl-butyl]amino]ethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[[3-(2,2-dimethyl-4-oxanyl)-4-phenylbutyl]amino]ethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[[3-(2,2-dimethyloxan-4-yl)-4-phenylbutyl]amino]ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-[[3-(2,2-dimethyltetrahydropyran-4-yl)-4-phenyl-butyl]amino]ethyl-dimethyl-ammonium binoxalate Formula: C23H38N2O5 MolecularWeight: 422.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CCNCC[NH+](C)C)CC2=CC=CC=C2)C.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC1(CC(CCO1)C(CCNCC[NH+](C)C)CC2=CC=CC=C2)C.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C21H36N2O.C2H2O4/c1-21(2)17-20(11-15-24-21)19(10-12-22-13-14-23(3)4)16-18-8-6-5-7-9-18;3-1(4)2(5)6/h5-9,19-20,22H,10-17H2,1-4H3;(H,3,4)(H,5,6)