(3R)-1-[[4-(3,5-dimethylphenoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3R)-1-[[4-(3,5-dimethylphenoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3R)-1-[[4-(3,5-dimethylphenoxy)phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3R)-1-[[4-(3,5-dimethylphenoxy)phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3R)-1-[[4-(3,5-dimethylphenoxy)phenyl]methyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: (3R)-1-[4-(3,5-dimethylphenoxy)benzyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC=C(C=C2)CN3CC(CC3=O)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC=C(C=C2)CN3C[C@@H](CC3=O)C(=O)O)C

InChI

InChI=1S/C20H21NO4/c1-13-7-14(2)9-18(8-13)25-17-5-3-15(4-6-17)11-21-12-16(20(23)24)10-19(21)22/h3-9,16H,10-12H2,1-2H3,(H,23,24)/t16-/m1/s1