sodium 2-[(2-methylpropan-2-yl)oxycarbonyl]benzoate

Systemtic Name: sodium 2-[(2-methylpropan-2-yl)oxycarbonyl]benzoate Openeye Name: sodium 2-tert-butoxycarbonylbenzoate CAS Name: sodium 2-[(2-methylpropan-2-yl)oxy-oxomethyl]benzoate IUPAC Name: sodium 2-[(2-methylpropan-2-yl)oxycarbonyl]benzoate Traditional Name: sodium 2-tert-butoxycarbonylbenzoate Formula: C12H13NaO4 MolecularWeight: 244.21899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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