tert-butyl (2S)-2-[(4-bromanyl-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(4-bromanyl-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(4-bromo-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(4-bromo-3-methylphenoxy)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(4-bromo-3-methylphenoxy)methyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(4-bromo-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H24BrNO3 MolecularWeight: 370.28136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2CCCN2C(=O)OC(C)(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@@H]2CCCN2C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C17H24BrNO3/c1-12-10-14(7-8-15(12)18)21-11-13-6-5-9-19(13)16(20)22-17(2,3)4/h7-8,10,13H,5-6,9,11H2,1-4H3/t13-/m0/s1