[(1S,2R)-2-(dibutylcarbamoyl)-2-phenyl-cyclopropyl]methylazanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [(1S,2R)-2-(dibutylcarbamoyl)-2-phenyl-cyclopropyl]methylazanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [(1S,2R)-2-(dibutylcarbamoyl)-2-phenyl-cyclopropyl]methylammonium; 2-hydroxy-2-oxo-acetate CAS Name: [(1S,2R)-2-[(dibutylamino)-oxomethyl]-2-phenylcyclopropyl]methylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: [(1S,2R)-2-(dibutylcarbamoyl)-2-phenylcyclopropyl]methylazanium; 2-hydroxy-2-oxoacetate Traditional Name: [(1S,2R)-2-(dibutylcarbamoyl)-2-phenyl-cyclopropyl]methylammonium binoxalate Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1(CC1C[NH3+])C2=CC=CC=C2.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCCCN(CCCC)C(=O)[C@@]1(C[C@@H]1C[NH3+])C2=CC=CC=C2.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C19H30N2O.C2H2O4/c1-3-5-12-21(13-6-4-2)18(22)19(14-17(19)15-20)16-10-8-7-9-11-16;3-1(4)2(5)6/h7-11,17H,3-6,12-15,20H2,1-2H3;(H,3,4)(H,5,6)/t17-,19+;/m1./s1