(3S)-1-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[[3-methoxy-4-(p-tolylmethoxy)phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[3-methoxy-4-(4-methylbenzyl)oxy-benzyl]pyrrolidine-3-carboxylate Formula: C21H22NO5- MolecularWeight: 368.40308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)CN3CC(CC3=O)C(=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)CN3C[C@H](CC3=O)C(=O)[O-])OC

InChI

InChI=1S/C21H23NO5/c1-14-3-5-15(6-4-14)13-27-18-8-7-16(9-19(18)26-2)11-22-12-17(21(24)25)10-20(22)23/h3-9,17H,10-13H2,1-2H3,(H,24,25)/p-1/t17-/m0/s1