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

Systemtic Name: methyl 5-[(2S)-2-(2-chloranyl-4-cyano-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)OC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C18H17ClN2O4/c1-9-15(18(23)24-4)10(2)21-16(9)17(22)11(3)25-14-6-5-12(8-20)7-13(14)19/h5-7,11,21H,1-4H3/t11-/m0/s1