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

Systemtic Name: (3R)-1-[[3-ethoxy-4-(2-phenoxyethoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[[3-ethoxy-4-(2-phenoxyethoxy)phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[[3-ethoxy-4-(2-phenoxyethoxy)phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[[3-ethoxy-4-(2-phenoxyethoxy)phenyl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-[3-ethoxy-4-(2-phenoxyethoxy)benzyl]-5-keto-pyrrolidine-3-carboxylate Formula: C22H24NO6- MolecularWeight: 398.42906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CC(CC2=O)C(=O)[O-])OCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2C[C@@H](CC2=O)C(=O)[O-])OCCOC3=CC=CC=C3

InChI

InChI=1S/C22H25NO6/c1-2-27-20-12-16(14-23-15-17(22(25)26)13-21(23)24)8-9-19(20)29-11-10-28-18-6-4-3-5-7-18/h3-9,12,17H,2,10-11,13-15H2,1H3,(H,25,26)/p-1/t17-/m1/s1