4-methoxy-2-oxidanyl-6-(2-oxidanylidenetridecyl)benzoic acid

Systemtic Name: 4-methoxy-2-oxidanyl-6-(2-oxidanylidenetridecyl)benzoic acid Openeye Name: 2-hydroxy-4-methoxy-6-(2-oxotridecyl)benzoic acid CAS Name: 2-hydroxy-4-methoxy-6-(2-oxotridecyl)benzoic acid IUPAC Name: 2-hydroxy-4-methoxy-6-(2-oxotridecyl)benzoic acid Traditional Name: 2-hydroxy-6-(2-ketotridecyl)-4-methoxy-benzoic acid Formula: C21H32O5 MolecularWeight: 364.47578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)CC1=CC(=CC(=C1C(=O)O)O)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)CC1=CC(=CC(=C1C(=O)O)O)OC

InChI

InChI=1S/C21H32O5/c1-3-4-5-6-7-8-9-10-11-12-17(22)13-16-14-18(26-2)15-19(23)20(16)21(24)25/h14-15,23H,3-13H2,1-2H3,(H,24,25)