5-chloranyl-2-methoxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Openeye Name: 4-(tert-butoxycarbonylamino)-5-chloro-2-methoxy-benzoic acid CAS Name: 5-chloro-2-methoxy-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Traditional Name: 4-(tert-butoxycarbonylamino)-5-chloro-2-methoxy-benzoic acid Formula: C13H16ClNO5 MolecularWeight: 301.72284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO5/c1-13(2,3)20-12(18)15-9-6-10(19-4)7(11(16)17)5-8(9)14/h5-6H,1-4H3,(H,15,18)(H,16,17)