(3S)-1-(2,6-dimethylphenyl)-N-(4-ethanoylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(2,6-dimethylphenyl)-N-(4-ethanoylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(4-acetylphenyl)-1-(2,6-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(4-acetylphenyl)-1-(2,6-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(4-acetylphenyl)-1-(2,6-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(4-acetylphenyl)-1-(2,6-dimethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C[C@H](CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H22N2O3/c1-13-5-4-6-14(2)20(13)23-12-17(11-19(23)25)21(26)22-18-9-7-16(8-10-18)15(3)24/h4-10,17H,11-12H2,1-3H3,(H,22,26)/t17-/m0/s1