(3S)-1-(2,5-dimethylphenyl)-N-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(2,5-dimethylphenyl)-N-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(2,5-dimethylphenyl)-N-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(2,5-dimethylphenyl)-N-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(2,5-dimethylphenyl)-N-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(2,5-dimethylphenyl)-5-keto-N-p-phenetyl-pyrrolidine-3-carboxamide Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H24N2O3/c1-4-26-18-9-7-17(8-10-18)22-21(25)16-12-20(24)23(13-16)19-11-14(2)5-6-15(19)3/h5-11,16H,4,12-13H2,1-3H3,(H,22,25)/t16-/m0/s1