4-chloranyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: 4-chloranyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: 3-(tert-butoxycarbonylamino)-4-chloro-benzoate CAS Name: 4-chloro-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoate IUPAC Name: 4-chloro-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 3-(tert-butoxycarbonylamino)-4-chloro-benzoate Formula: C12H13ClNO4- MolecularWeight: 270.68892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)C(=O)[O-])Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)C(=O)[O-])Cl

InChI

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