2-[methoxy-(1-oxidanylcyclohexyl)-phenyl-methoxy]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[methoxy-(1-oxidanylcyclohexyl)-phenyl-methoxy]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[(1-hydroxycyclohexyl)-methoxy-phenyl-methoxy]ethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[(1-hydroxycyclohexyl)-methoxy-phenylmethoxy]ethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[(1-hydroxycyclohexyl)-methoxy-phenylmethoxy]ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-[(1-hydroxycyclohexyl)-methoxy-phenyl-methoxy]ethyl-dimethyl-ammonium binoxalate Formula: C20H31NO7 MolecularWeight: 397.46264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC(C1=CC=CC=C1)(C2(CCCCC2)O)OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+](C)CCOC(C1=CC=CC=C1)(C2(CCCCC2)O)OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H29NO3.C2H2O4/c1-19(2)14-15-22-18(21-3,16-10-6-4-7-11-16)17(20)12-8-5-9-13-17;3-1(4)2(5)6/h4,6-7,10-11,20H,5,8-9,12-15H2,1-3H3;(H,3,4)(H,5,6)