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

Systemtic Name: ethyl 5-[(2S)-2-(2-chloranyl-4-cyano-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(2S)-2-(2-chloro-4-cyano-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-(2-chloro-4-cyanophenoxy)-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2S)-2-(2-chloro-4-cyanophenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-(2-chloro-4-cyano-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC2=C(C=C(C=C2)C#N)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)OC2=C(C=C(C=C2)C#N)Cl)C

InChI

InChI=1S/C19H19ClN2O4/c1-5-25-19(24)16-10(2)17(22-11(16)3)18(23)12(4)26-15-7-6-13(9-21)8-14(15)20/h6-8,12,22H,5H2,1-4H3/t12-/m0/s1