(3S)-1-[(3-ethoxy-4-propoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[(3-ethoxy-4-propoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[(3-ethoxy-4-propoxy-phenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(3-ethoxy-4-propoxyphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[(3-ethoxy-4-propoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3-ethoxy-4-propoxy-benzyl)-5-keto-pyrrolidine-3-carboxylate Formula: C17H22NO5- MolecularWeight: 320.36028

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CN2CC(CC2=O)C(=O)[O-])OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CN2C[C@H](CC2=O)C(=O)[O-])OCC

InChI

InChI=1S/C17H23NO5/c1-3-7-23-14-6-5-12(8-15(14)22-4-2)10-18-11-13(17(20)21)9-16(18)19/h5-6,8,13H,3-4,7,9-11H2,1-2H3,(H,20,21)/p-1/t13-/m0/s1