(3R)-N-(3-ethynylphenyl)-1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3R)-N-(3-ethynylphenyl)-1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3R)-N-(3-ethynylphenyl)-1-(2-methoxy-5-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3R)-N-(3-ethynylphenyl)-1-(2-methoxy-5-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3R)-N-(3-ethynylphenyl)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3R)-N-(3-ethynylphenyl)-5-keto-1-(2-methoxy-5-methyl-phenyl)pyrrolidine-3-carboxamide Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O3/c1-4-15-6-5-7-17(11-15)22-21(25)16-12-20(24)23(13-16)18-10-14(2)8-9-19(18)26-3/h1,5-11,16H,12-13H2,2-3H3,(H,22,25)/t16-/m1/s1