tert-butyl 3-[[2-bromanyl-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-bromanyl-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-bromo-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidine-1-carboxylate CAS Name: 3-[[2-bromo-5-(1-methoxyethoxy)phenyl]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-bromo-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidine-1-carboxylate Traditional Name: 3-[2-bromo-5-(1-methoxyethoxy)benzyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H28BrNO4 MolecularWeight: 414.33392

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OC1=CC(=C(C=C1)Br)CC2CCN(C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(OC)OC1=CC(=C(C=C1)Br)CC2CCN(C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H28BrNO4/c1-13(23-5)24-16-6-7-17(20)15(11-16)10-14-8-9-21(12-14)18(22)25-19(2,3)4/h6-7,11,13-14H,8-10,12H2,1-5H3