2-chloranyl-5-(hexanoylamino)benzoic acid

Systemtic Name: 2-chloranyl-5-(hexanoylamino)benzoic acid Openeye Name: 2-chloro-5-(hexanoylamino)benzoic acid CAS Name: 2-chloro-5-(1-oxohexylamino)benzoic acid IUPAC Name: 2-chloro-5-(hexanoylamino)benzoic acid Traditional Name: 5-(caproylamino)-2-chloro-benzoic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC(=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CCCCCC(=O)NC1=CC(=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C13H16ClNO3/c1-2-3-4-5-12(16)15-9-6-7-11(14)10(8-9)13(17)18/h6-8H,2-5H2,1H3,(H,15,16)(H,17,18)