O1-ethyl O3-[(2R)-1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[(2R)-1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[(1R)-2-(4-fluorophenyl)-1-methyl-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[(2R)-1-(4-fluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-ethyl 3-O-[(2R)-1-(4-fluorophenyl)-1-oxopropan-2-yl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[(1R)-2-(4-fluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C19H16FNO7 MolecularWeight: 389.331243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O[C@H](C)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H16FNO7/c1-3-27-18(23)13-8-14(10-16(9-13)21(25)26)19(24)28-11(2)17(22)12-4-6-15(20)7-5-12/h4-11H,3H2,1-2H3/t11-/m1/s1