(3S)-1-(3-chloranyl-4-methyl-phenyl)-N-(cyanomethyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(3-chloranyl-4-methyl-phenyl)-N-(cyanomethyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(3-chloro-4-methyl-phenyl)-N-(cyanomethyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(3-chloro-4-methylphenyl)-N-(cyanomethyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(3-chloro-4-methylphenyl)-N-(cyanomethyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(3-chloro-4-methyl-phenyl)-N-(cyanomethyl)-5-keto-pyrrolidine-3-carboxamide Formula: C14H14ClN3O2 MolecularWeight: 291.73286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NCC#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)NCC#N)Cl

InChI

InChI=1S/C14H14ClN3O2/c1-9-2-3-11(7-12(9)15)18-8-10(6-13(18)19)14(20)17-5-4-16/h2-3,7,10H,5-6,8H2,1H3,(H,17,20)/t10-/m0/s1