(3R)-1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3R)-1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[[4-(2,5-dimethylphenoxy)phenyl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-[4-(2,5-dimethylphenoxy)benzyl]-5-keto-pyrrolidine-3-carboxylate Formula: C20H20NO4- MolecularWeight: 338.3771

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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