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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

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