(3S)-1-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[(4-isopropoxy-3-methoxy-phenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(4-isopropoxy-3-methoxy-benzyl)-5-keto-pyrrolidine-3-carboxylate Formula: C16H20NO5- MolecularWeight: 306.3337

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CN2CC(CC2=O)C(=O)[O-])OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CN2C[C@H](CC2=O)C(=O)[O-])OC

InChI

InChI=1S/C16H21NO5/c1-10(2)22-13-5-4-11(6-14(13)21-3)8-17-9-12(16(19)20)7-15(17)18/h4-6,10,12H,7-9H2,1-3H3,(H,19,20)/p-1/t12-/m0/s1