(3R)-1-[2-[4-(4-chloranyl-3-methyl-phenoxy)phenyl]ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3R)-1-[2-[4-(4-chloranyl-3-methyl-phenoxy)phenyl]ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[2-[4-(4-chloro-3-methyl-phenoxy)phenyl]ethyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[2-[4-(4-chloro-3-methylphenoxy)phenyl]ethyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[2-[4-(4-chloro-3-methylphenoxy)phenyl]ethyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-[2-[4-(4-chloro-3-methyl-phenoxy)phenyl]ethyl]-5-keto-pyrrolidine-3-carboxylate Formula: C20H19ClNO4- MolecularWeight: 372.82216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)CCN3CC(CC3=O)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)CCN3C[C@@H](CC3=O)C(=O)[O-])Cl

InChI

InChI=1S/C20H20ClNO4/c1-13-10-17(6-7-18(13)21)26-16-4-2-14(3-5-16)8-9-22-12-15(20(24)25)11-19(22)23/h2-7,10,15H,8-9,11-12H2,1H3,(H,24,25)/p-1/t15-/m1/s1