methyl (2S)-4-(2-bromanyl-4-methyl-phenoxy)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-4-(2-bromanyl-4-methyl-phenoxy)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-4-(2-bromo-4-methyl-phenoxy)pyrrolidine-2-carboxylate CAS Name: (2S)-4-(2-bromo-4-methylphenoxy)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-4-(2-bromo-4-methylphenoxy)pyrrolidine-2-carboxylate Traditional Name: (2S)-4-(2-bromo-4-methyl-phenoxy)pyrrolidine-2-carboxylic acid methyl ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2CC(NC2)C(=O)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2C[C@H](NC2)C(=O)OC)Br

InChI

InChI=1S/C13H16BrNO3/c1-8-3-4-12(10(14)5-8)18-9-6-11(15-7-9)13(16)17-2/h3-5,9,11,15H,6-7H2,1-2H3/t9?,11-/m0/s1