O4-ethyl O2-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-(2-methyl-6-nitroanilino)-2-oxoethyl] ester IUPAC Name: 4-O-ethyl 2-O-[2-(2-methyl-6-nitroanilino)-2-oxoethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-keto-2-(2-methyl-6-nitro-anilino)ethyl] ester Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=C(C=CC=C2[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=C(C=CC=C2[N+](=O)[O-])C)C

InChI

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