4-(1-oxidanylpropoxycarbonyl)benzoic acid

Systemtic Name: 4-(1-oxidanylpropoxycarbonyl)benzoic acid Openeye Name: 4-(1-hydroxypropoxycarbonyl)benzoic acid CAS Name: 4-[1-hydroxypropoxy(oxo)methyl]benzoic acid IUPAC Name: 4-(1-hydroxypropoxycarbonyl)benzoic acid Traditional Name: 4-(1-hydroxypropoxycarbonyl)benzoic acid Formula: C11H12O5 MolecularWeight: 224.20998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(O)OC(=O)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCC(O)OC(=O)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H12O5/c1-2-9(12)16-11(15)8-5-3-7(4-6-8)10(13)14/h3-6,9,12H,2H2,1H3,(H,13,14)