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

Systemtic Name: (3R)-1-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[[3-[2-(4-methylphenoxy)ethoxy]phenyl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-[3-[2-(4-methylphenoxy)ethoxy]benzyl]pyrrolidine-3-carboxylate Formula: C21H22NO5- MolecularWeight: 368.40308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCOC2=CC=CC(=C2)CN3CC(CC3=O)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCOC2=CC=CC(=C2)CN3C[C@@H](CC3=O)C(=O)[O-]

InChI

InChI=1S/C21H23NO5/c1-15-5-7-18(8-6-15)26-9-10-27-19-4-2-3-16(11-19)13-22-14-17(21(24)25)12-20(22)23/h2-8,11,17H,9-10,12-14H2,1H3,(H,24,25)/p-1/t17-/m1/s1