[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl] 4-ethoxy-5-methoxy-2-nitro-benzoate

Systemtic Name: [2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl] 4-ethoxy-5-methoxy-2-nitro-benzoate Openeye Name: (2-tert-butoxy-2-oxo-ethyl) 4-ethoxy-5-methoxy-2-nitro-benzoate CAS Name: 4-ethoxy-5-methoxy-2-nitrobenzoic acid [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl] 4-ethoxy-5-methoxy-2-nitrobenzoate Traditional Name: 4-ethoxy-5-methoxy-2-nitro-benzoic acid (2-tert-butoxy-2-keto-ethyl) ester Formula: C16H21NO8 MolecularWeight: 355.33984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OCC(=O)OC(C)(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OCC(=O)OC(C)(C)C)OC

InChI

InChI=1S/C16H21NO8/c1-6-23-13-8-11(17(20)21)10(7-12(13)22-5)15(19)24-9-14(18)25-16(2,3)4/h7-8H,6,9H2,1-5H3