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

Systemtic Name: (3S)-1-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[(3-bromo-5-methoxy-4-propoxy-phenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(3-bromo-5-methoxy-4-propoxyphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[(3-bromo-5-methoxy-4-propoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3-bromo-5-methoxy-4-propoxy-benzyl)-5-keto-pyrrolidine-3-carboxylate Formula: C16H19BrNO5- MolecularWeight: 385.22976

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)CN2CC(CC2=O)C(=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)CN2C[C@H](CC2=O)C(=O)[O-])OC

InChI

InChI=1S/C16H20BrNO5/c1-3-4-23-15-12(17)5-10(6-13(15)22-2)8-18-9-11(16(20)21)7-14(18)19/h5-6,11H,3-4,7-9H2,1-2H3,(H,20,21)/p-1/t11-/m0/s1