2-oxidanylbutanedioate; tetrabutylazanium; hydrate

Systemtic Name: 2-oxidanylbutanedioate; tetrabutylazanium; hydrate Openeye Name: 2-hydroxybutanedioate; tetrabutylammonium; hydrate CAS Name: 2-hydroxybutanedioate; tetrabutylammonium; hydrate IUPAC Name: 2-hydroxybutanedioate; tetrabutylazanium; hydrate Traditional Name: 2-hydroxysuccinate; tetrabutylammonium; hydrate Formula: C36H78N2O6 MolecularWeight: 635.01432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C(C(C(=O)[O-])O)C(=O)[O-].O

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C(C(C(=O)[O-])O)C(=O)[O-].O

InChI

InChI=1S/2C16H36N.C4H6O5.H2O/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;5-2(4(8)9)1-3(6)7;/h2*5-16H2,1-4H3;2,5H,1H2,(H,6,7)(H,8,9);1H2/q2*+1;;/p-2