azanium 2-butan-2-yloxycarbonylbenzoate

Systemtic Name: azanium 2-butan-2-yloxycarbonylbenzoate Openeye Name: ammonium 2-sec-butoxycarbonylbenzoate CAS Name: ammonium 2-[butan-2-yloxy(oxo)methyl]benzoate IUPAC Name: azanium 2-butan-2-yloxycarbonylbenzoate Traditional Name: ammonium 2-sec-butoxycarbonylbenzoate Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=CC=CC=C1C(=O)[O-].[NH4+]

Isomeric SMILES

CCC(C)OC(=O)C1=CC=CC=C1C(=O)[O-].[NH4+]

InChI

InChI=1S/C12H14O4.H3N/c1-3-8(2)16-12(15)10-7-5-4-6-9(10)11(13)14;/h4-8H,3H2,1-2H3,(H,13,14);1H3