methyl 3-nitro-4-[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethoxy]benzoate

Systemtic Name: methyl 3-nitro-4-[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethoxy]benzoate Openeye Name: methyl 4-[2-(4-isopropylphenyl)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 3-nitro-4-[2-oxo-2-(4-propan-2-ylphenyl)ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[2-oxo-2-(4-propan-2-ylphenyl)ethoxy]benzoate Traditional Name: 4-(2-keto-2-p-cumenyl-ethoxy)-3-nitro-benzoic acid methyl ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H19NO6/c1-12(2)13-4-6-14(7-5-13)17(21)11-26-18-9-8-15(19(22)25-3)10-16(18)20(23)24/h4-10,12H,11H2,1-3H3