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

Systemtic Name: ethyl 4-[2-(2-chloranyl-4-nitro-phenoxy)ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-(2-chloro-4-nitro-phenoxy)acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-(2-chloro-4-nitrophenoxy)-1-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-chloro-4-nitrophenoxy)acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-(2-chloro-4-nitro-phenoxy)acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H17ClN2O6 MolecularWeight: 380.77968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C17H17ClN2O6/c1-4-25-17(22)16-9(2)15(10(3)19-16)13(21)8-26-14-6-5-11(20(23)24)7-12(14)18/h5-7,19H,4,8H2,1-3H3