ethyl (3R,4S)-4-(4-bromophenyl)pyrrolidine-3-carboxylate

Systemtic Name: ethyl (3R,4S)-4-(4-bromophenyl)pyrrolidine-3-carboxylate Openeye Name: ethyl (3R,4S)-4-(4-bromophenyl)pyrrolidine-3-carboxylate CAS Name: (3R,4S)-4-(4-bromophenyl)-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4S)-4-(4-bromophenyl)pyrrolidine-3-carboxylate Traditional Name: (3R,4S)-4-(4-bromophenyl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C13H16BrNO2 MolecularWeight: 298.17564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CNCC1C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)[C@H]1CNC[C@@H]1C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H16BrNO2/c1-2-17-13(16)12-8-15-7-11(12)9-3-5-10(14)6-4-9/h3-6,11-12,15H,2,7-8H2,1H3/t11-,12+/m1/s1