(2,3-dimethyl-3-oxidanyl-butan-2-yl)azanium; 2-ethylhexanoate

Systemtic Name: (2,3-dimethyl-3-oxidanyl-butan-2-yl)azanium; 2-ethylhexanoate Openeye Name: 2-ethylhexanoate; (2-hydroxy-1,1,2-trimethyl-propyl)ammonium CAS Name: 2-ethylhexanoate; (3-hydroxy-2,3-dimethylbutan-2-yl)ammonium IUPAC Name: 2-ethylhexanoate; (3-hydroxy-2,3-dimethylbutan-2-yl)azanium Traditional Name: 2-ethylhexanoate; (2-hydroxy-1,1,2-trimethyl-propyl)ammonium Formula: C14H31NO3 MolecularWeight: 261.40084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].CC(C)(C(C)(C)O)[NH3+]

Isomeric SMILES

CCCCC(CC)C(=O)[O-].CC(C)(C(C)(C)O)[NH3+]

InChI

InChI=1S/C8H16O2.C6H15NO/c1-3-5-6-7(4-2)8(9)10;1-5(2,7)6(3,4)8/h7H,3-6H2,1-2H3,(H,9,10);8H,7H2,1-4H3