azanium (E)-2-tert-butyl-5-oxidanyl-hex-2-enoate

Systemtic Name: azanium (E)-2-tert-butyl-5-oxidanyl-hex-2-enoate Openeye Name: ammonium (E)-2-tert-butyl-5-hydroxy-hex-2-enoate CAS Name: ammonium (E)-2-tert-butyl-5-hydroxy-2-hexenoate IUPAC Name: azanium (E)-2-tert-butyl-5-hydroxyhex-2-enoate Traditional Name: ammonium (E)-2-tert-butyl-5-hydroxy-hex-2-enoate Formula: C10H21NO3 MolecularWeight: 203.27864

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C(C(=O)[O-])C(C)(C)C)O.[NH4+]

Isomeric SMILES

CC(C/C=C(/C(=O)[O-])\C(C)(C)C)O.[NH4+]

InChI

InChI=1S/C10H18O3.H3N/c1-7(11)5-6-8(9(12)13)10(2,3)4;/h6-7,11H,5H2,1-4H3,(H,12,13);1H3/b8-6-;