(3S)-5-oxidanylidene-1-[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]pyrrolidine-3-carboxylic acid

Systemtic Name: (3S)-5-oxidanylidene-1-[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]pyrrolidine-3-carboxylic acid Openeye Name: (3S)-1-[4-[4-(1-methyl-1-phenyl-ethyl)phenoxy]phenyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3S)-5-oxo-1-[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]-3-pyrrolidinecarboxylic acid IUPAC Name: (3S)-5-oxo-1-[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]pyrrolidine-3-carboxylic acid Traditional Name: (3S)-1-[4-(4-cumylphenoxy)phenyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC=C(C=C3)N4CC(CC4=O)C(=O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC=C(C=C3)N4C[C@H](CC4=O)C(=O)O

InChI

InChI=1S/C26H25NO4/c1-26(2,19-6-4-3-5-7-19)20-8-12-22(13-9-20)31-23-14-10-21(11-15-23)27-17-18(25(29)30)16-24(27)28/h3-15,18H,16-17H2,1-2H3,(H,29,30)/t18-/m0/s1