(3R)-5-oxidanylidene-1-[[4-(3-phenylpropoxy)phenyl]methyl]pyrrolidine-3-carboxylate

Systemtic Name: (3R)-5-oxidanylidene-1-[[4-(3-phenylpropoxy)phenyl]methyl]pyrrolidine-3-carboxylate Openeye Name: (3R)-5-oxo-1-[[4-(3-phenylpropoxy)phenyl]methyl]pyrrolidine-3-carboxylate CAS Name: (3R)-5-oxo-1-[[4-(3-phenylpropoxy)phenyl]methyl]-3-pyrrolidinecarboxylate IUPAC Name: (3R)-5-oxo-1-[[4-(3-phenylpropoxy)phenyl]methyl]pyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-[4-(3-phenylpropoxy)benzyl]pyrrolidine-3-carboxylate Formula: C21H22NO4- MolecularWeight: 352.40368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=C(C=C2)OCCCC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1[C@H](CN(C1=O)CC2=CC=C(C=C2)OCCCC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C21H23NO4/c23-20-13-18(21(24)25)15-22(20)14-17-8-10-19(11-9-17)26-12-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-11,18H,4,7,12-15H2,(H,24,25)/p-1/t18-/m1/s1