O2-[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(2-fluoro-5-nitro-anilino)-2-oxo-ethyl] O4-isopropyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(2-fluoro-5-nitroanilino)-2-oxoethyl] ester O4-propan-2-yl ester IUPAC Name: 2-O-[2-(2-fluoro-5-nitroanilino)-2-oxoethyl] 4-O-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(2-fluoro-5-nitro-anilino)-2-keto-ethyl] ester O4-isopropyl ester Formula: C19H20FN3O7 MolecularWeight: 421.376403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C19H20FN3O7/c1-9(2)30-18(25)16-10(3)17(21-11(16)4)19(26)29-8-15(24)22-14-7-12(23(27)28)5-6-13(14)20/h5-7,9,21H,8H2,1-4H3,(H,22,24)