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

Systemtic Name: (3S)-1-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3-bromo-4-ethoxy-5-methoxy-benzyl)-5-keto-pyrrolidine-3-carboxylate Formula: C15H17BrNO5- MolecularWeight: 371.20318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)CN2CC(CC2=O)C(=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)CN2C[C@H](CC2=O)C(=O)[O-])OC

InChI

InChI=1S/C15H18BrNO5/c1-3-22-14-11(16)4-9(5-12(14)21-2)7-17-8-10(15(19)20)6-13(17)18/h4-5,10H,3,6-8H2,1-2H3,(H,19,20)/p-1/t10-/m0/s1