4-[(2-methylpropan-2-yl)oxycarbonyl]-2-nitro-benzoic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-2-nitro-benzoic acid Openeye Name: 4-tert-butoxycarbonyl-2-nitro-benzoic acid CAS Name: 4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-nitrobenzoic acid IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-2-nitrobenzoic acid Traditional Name: 4-tert-butoxycarbonyl-2-nitro-benzoic acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO6/c1-12(2,3)19-11(16)7-4-5-8(10(14)15)9(6-7)13(17)18/h4-6H,1-3H3,(H,14,15)