ethyl 2,5-dimethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(3-methyl-4-nitro-phenoxy)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(3-methyl-4-nitrophenoxy)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[2-(3-methyl-4-nitro-phenoxy)acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C)C

InChI

InChI=1S/C18H20N2O6/c1-5-25-18(22)17-12(4)19-11(3)16(17)15(21)9-26-13-6-7-14(20(23)24)10(2)8-13/h6-8,19H,5,9H2,1-4H3