(3S)-N-(cyanomethyl)-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(cyanomethyl)-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(cyanomethyl)-1-(2,4-dimethoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(cyanomethyl)-1-(2,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(cyanomethyl)-1-(2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(cyanomethyl)-1-(2,4-dimethoxyphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)NCC#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C[C@H](CC2=O)C(=O)NCC#N)OC

InChI

InChI=1S/C15H17N3O4/c1-21-11-3-4-12(13(8-11)22-2)18-9-10(7-14(18)19)15(20)17-6-5-16/h3-4,8,10H,6-7,9H2,1-2H3,(H,17,20)/t10-/m0/s1