(3S)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-N-(3-cyanophenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-N-(3-cyanophenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(5-chloro-2,4-dimethoxy-phenyl)-N-(3-cyanophenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(5-chloro-2,4-dimethoxyphenyl)-N-(3-cyanophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(5-chloro-2,4-dimethoxyphenyl)-N-(3-cyanophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(5-chloro-2,4-dimethoxy-phenyl)-N-(3-cyanophenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C#N)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1N2C[C@H](CC2=O)C(=O)NC3=CC=CC(=C3)C#N)Cl)OC

InChI

InChI=1S/C20H18ClN3O4/c1-27-17-9-18(28-2)16(8-15(17)21)24-11-13(7-19(24)25)20(26)23-14-5-3-4-12(6-14)10-22/h3-6,8-9,13H,7,11H2,1-2H3,(H,23,26)/t13-/m0/s1