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

Systemtic Name: ethyl 4-[2-(2-chloranyl-4-cyano-phenoxy)ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-(2-chloro-4-cyano-phenoxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-(2-chloro-4-cyanophenoxy)-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-chloro-4-cyanophenoxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(2-chloro-4-cyano-phenoxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC2=C(C=C(C=C2)C#N)Cl)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC2=C(C=C(C=C2)C#N)Cl)C)C

InChI

InChI=1S/C18H17ClN2O4/c1-4-24-18(23)17-11(3)21-10(2)16(17)14(22)9-25-15-6-5-12(8-20)7-13(15)19/h5-7,21H,4,9H2,1-3H3