5-dodecanoyl-2-oxidanyl-benzoate; (2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: 5-dodecanoyl-2-oxidanyl-benzoate; (2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: 5-dodecanoyl-2-hydroxy-benzoate; (2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: (1-hydroxy-2-methylpropan-2-yl)ammonium; 2-hydroxy-5-(1-oxododecyl)benzoate IUPAC Name: 5-dodecanoyl-2-hydroxybenzoate; (1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (2-hydroxy-1,1-dimethyl-ethyl)ammonium; 2-hydroxy-5-lauroyl-benzoate Formula: C23H39NO5 MolecularWeight: 409.55946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)[O-].CC(C)(CO)[NH3+]

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)[O-].CC(C)(CO)[NH3+]

InChI

InChI=1S/C19H28O4.C4H11NO/c1-2-3-4-5-6-7-8-9-10-11-17(20)15-12-13-18(21)16(14-15)19(22)23;1-4(2,5)3-6/h12-14,21H,2-11H2,1H3,(H,22,23);6H,3,5H2,1-2H3