3-(2-methylpropoxycarbonyl)-4-oxidanyl-benzoic acid

Systemtic Name: 3-(2-methylpropoxycarbonyl)-4-oxidanyl-benzoic acid Openeye Name: 4-hydroxy-3-isobutoxycarbonyl-benzoic acid CAS Name: 4-hydroxy-3-[2-methylpropoxy(oxo)methyl]benzoic acid IUPAC Name: 4-hydroxy-3-(2-methylpropoxycarbonyl)benzoic acid Traditional Name: 4-hydroxy-3-isobutoxycarbonyl-benzoic acid Formula: C12H14O5 MolecularWeight: 238.23656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=C(C=CC(=C1)C(=O)O)O

Isomeric SMILES

CC(C)COC(=O)C1=C(C=CC(=C1)C(=O)O)O

InChI

InChI=1S/C12H14O5/c1-7(2)6-17-12(16)9-5-8(11(14)15)3-4-10(9)13/h3-5,7,13H,6H2,1-2H3,(H,14,15)