tert-butyl-[3-[4-[(3,4-dimethoxyphenyl)carbonylamino]phenoxy]-2-oxidanyl-propyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: tert-butyl-[3-[4-[(3,4-dimethoxyphenyl)carbonylamino]phenoxy]-2-oxidanyl-propyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: tert-butyl-[3-[4-[(3,4-dimethoxybenzoyl)amino]phenoxy]-2-hydroxy-propyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: tert-butyl-[3-[4-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]phenoxy]-2-hydroxypropyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: tert-butyl-[3-[4-[(3,4-dimethoxybenzoyl)amino]phenoxy]-2-hydroxypropyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: tert-butyl-[2-hydroxy-3-[4-(veratroylamino)phenoxy]propyl]ammonium binoxalate Formula: C24H32N2O9 MolecularWeight: 492.51888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)OC)O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC(C)(C)[NH2+]CC(COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)OC)O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C22H30N2O5.C2H2O4/c1-22(2,3)23-13-17(25)14-29-18-9-7-16(8-10-18)24-21(26)15-6-11-19(27-4)20(12-15)28-5;3-1(4)2(5)6/h6-12,17,23,25H,13-14H2,1-5H3,(H,24,26);(H,3,4)(H,5,6)