3-chloranyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid

Systemtic Name: 3-chloranyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-chloro-benzoic acid CAS Name: 3-chloro-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid IUPAC Name: 3-chloro-2-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-chloro-benzoic acid Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC=C1Cl)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC=C1Cl)C(=O)O

InChI

InChI=1S/C12H14ClNO4/c1-12(2,3)18-11(17)14-9-7(10(15)16)5-4-6-8(9)13/h4-6H,1-3H3,(H,14,17)(H,15,16)