4-(hexadecanoylamino)-2-oxidanyl-benzoic acid

Systemtic Name: 4-(hexadecanoylamino)-2-oxidanyl-benzoic acid Openeye Name: 4-(hexadecanoylamino)-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-4-(1-oxohexadecylamino)benzoic acid IUPAC Name: 4-(hexadecanoylamino)-2-hydroxybenzoic acid Traditional Name: 2-hydroxy-4-palmitamido-benzoic acid Formula: C23H37NO4 MolecularWeight: 391.54418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)C(=O)O)O

InChI

InChI=1S/C23H37NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(26)24-19-16-17-20(23(27)28)21(25)18-19/h16-18,25H,2-15H2,1H3,(H,24,26)(H,27,28)