O4-methyl O2-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-methyl O2-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-methyl O2-[1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O4-methyl ester O2-[1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: 4-O-methyl 2-O-[1-(3-nitroanilino)-1-oxopropan-2-yl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester O4-methyl ester Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O7/c1-5-14-15(18(24)28-4)10(2)16(21-14)19(25)29-11(3)17(23)20-12-7-6-8-13(9-12)22(26)27/h6-9,11,21H,5H2,1-4H3,(H,20,23)