tert-butyl 4-nitro-3-propan-2-yloxy-benzoate

Systemtic Name: tert-butyl 4-nitro-3-propan-2-yloxy-benzoate Openeye Name: tert-butyl 3-isopropoxy-4-nitro-benzoate CAS Name: 4-nitro-3-propan-2-yloxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-nitro-3-propan-2-yloxybenzoate Traditional Name: 3-isopropoxy-4-nitro-benzoic acid tert-butyl ester Formula: C14H19NO5 MolecularWeight: 281.30436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)C(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19NO5/c1-9(2)19-12-8-10(6-7-11(12)15(17)18)13(16)20-14(3,4)5/h6-9H,1-5H3