1-[(2-bromophenyl)-(3-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-bromophenyl)-(3-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-(2-bromophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromophenyl)-(3-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromophenyl)-(3-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-(2-bromophenyl)methyl]proline Formula: C25H24BrNO3 MolecularWeight: 466.36696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=C4Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=C4Br)C(=O)O

InChI

InChI=1S/C25H24BrNO3/c26-22-13-5-4-12-21(22)24(27-15-7-14-23(27)25(28)29)19-10-6-11-20(16-19)30-17-18-8-2-1-3-9-18/h1-6,8-13,16,23-24H,7,14-15,17H2,(H,28,29)