3-bromanyl-5-chloranyl-2-(pentylamino)benzoic acid

Systemtic Name: 3-bromanyl-5-chloranyl-2-(pentylamino)benzoic acid Openeye Name: 3-bromo-5-chloro-2-(pentylamino)benzoic acid CAS Name: 3-bromo-5-chloro-2-(pentylamino)benzoic acid IUPAC Name: 3-bromo-5-chloro-2-(pentylamino)benzoic acid Traditional Name: 2-(amylamino)-3-bromo-5-chloro-benzoic acid Formula: C12H15BrClNO2 MolecularWeight: 320.61

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1C(=O)O)Cl)Br

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1C(=O)O)Cl)Br

InChI

InChI=1S/C12H15BrClNO2/c1-2-3-4-5-15-11-9(12(16)17)6-8(14)7-10(11)13/h6-7,15H,2-5H2,1H3,(H,16,17)