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

Systemtic Name: O2-[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 4-O-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl] ester O4-methyl ester Formula: C18H18FN3O7 MolecularWeight: 407.349823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)OCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)OCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C)C(=O)OC

InChI

InChI=1S/C18H18FN3O7/c1-4-12-15(17(24)28-3)9(2)16(21-12)18(25)29-8-14(23)20-10-5-6-11(19)13(7-10)22(26)27/h5-7,21H,4,8H2,1-3H3,(H,20,23)