ethanedioate; (2-hydroxyphenyl)methyl-[6-[(2-hydroxyphenyl)methyl-methyl-azaniumyl]hexyl]-methyl-azanium

Systemtic Name: ethanedioate; (2-hydroxyphenyl)methyl-[6-[(2-hydroxyphenyl)methyl-methyl-azaniumyl]hexyl]-methyl-azanium Openeye Name: (2-hydroxyphenyl)methyl-[6-[(2-hydroxyphenyl)methyl-methyl-ammonio]hexyl]-methyl-ammonium; oxalate CAS Name: (2-hydroxyphenyl)methyl-[6-[(2-hydroxyphenyl)methyl-methylammonio]hexyl]-methylammonium; oxalate IUPAC Name: (2-hydroxyphenyl)methyl-[6-[(2-hydroxyphenyl)methyl-methylazaniumyl]hexyl]-methylazanium; oxalate Traditional Name: methyl-[6-[methyl(salicyl)ammonio]hexyl]-salicyl-ammonium; oxalate Formula: C24H34N2O6 MolecularWeight: 446.53656

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCCCC[NH+](C)CC1=CC=CC=C1O)CC2=CC=CC=C2O.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C[NH+](CCCCCC[NH+](C)CC1=CC=CC=C1O)CC2=CC=CC=C2O.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C22H32N2O2.C2H2O4/c1-23(17-19-11-5-7-13-21(19)25)15-9-3-4-10-16-24(2)18-20-12-6-8-14-22(20)26;3-1(4)2(5)6/h5-8,11-14,25-26H,3-4,9-10,15-18H2,1-2H3;(H,3,4)(H,5,6)