(3R)-1-[2-[4-(2-tert-butylphenoxy)phenyl]ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3R)-1-[2-[4-(2-tert-butylphenoxy)phenyl]ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[2-[4-(2-tert-butylphenoxy)phenyl]ethyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[2-[4-(2-tert-butylphenoxy)phenyl]ethyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[2-[4-(2-tert-butylphenoxy)phenyl]ethyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-[2-[4-(2-tert-butylphenoxy)phenyl]ethyl]-5-keto-pyrrolidine-3-carboxylate Formula: C23H26NO4- MolecularWeight: 380.45684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OC2=CC=C(C=C2)CCN3CC(CC3=O)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OC2=CC=C(C=C2)CCN3C[C@@H](CC3=O)C(=O)[O-]

InChI

InChI=1S/C23H27NO4/c1-23(2,3)19-6-4-5-7-20(19)28-18-10-8-16(9-11-18)12-13-24-15-17(22(26)27)14-21(24)25/h4-11,17H,12-15H2,1-3H3,(H,26,27)/p-1/t17-/m1/s1