(3S)-N-(3-chloranyl-4-cyano-phenyl)-1-cyclohexyl-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(3-chloranyl-4-cyano-phenyl)-1-cyclohexyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(3-chloro-4-cyano-phenyl)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(3-chloro-4-cyanophenyl)-1-cyclohexyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(3-chloro-4-cyanophenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(3-chloro-4-cyano-phenyl)-1-cyclohexyl-5-keto-pyrrolidine-3-carboxamide Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CC2=O)C(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

C1CCC(CC1)N2C[C@H](CC2=O)C(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H20ClN3O2/c19-16-9-14(7-6-12(16)10-20)21-18(24)13-8-17(23)22(11-13)15-4-2-1-3-5-15/h6-7,9,13,15H,1-5,8,11H2,(H,21,24)/t13-/m0/s1