1-[(3-bromophenyl)-(5-chloranylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-(5-chloranylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(5-chloro-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(5-chloro-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-(5-chlorothiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(5-chloro-2-thienyl)methyl]proline Formula: C16H15BrClNO2S MolecularWeight: 400.7178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC(=CC=C2)Br)C3=CC=C(S3)Cl)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC(=CC=C2)Br)C3=CC=C(S3)Cl)C(=O)O

InChI

InChI=1S/C16H15BrClNO2S/c17-11-4-1-3-10(9-11)15(13-6-7-14(18)22-13)19-8-2-5-12(19)16(20)21/h1,3-4,6-7,9,12,15H,2,5,8H2,(H,20,21)