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

Systemtic Name: 1-[(2-bromophenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-bromophenyl)-(3-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromophenyl)-(3-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromophenyl)-thiophen-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-bromophenyl)-(3-thienyl)methyl]proline Formula: C16H16BrNO2S MolecularWeight: 366.27274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CSC=C2)C3=CC=CC=C3Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CSC=C2)C3=CC=CC=C3Br)C(=O)O

InChI

InChI=1S/C16H16BrNO2S/c17-13-5-2-1-4-12(13)15(11-7-9-21-10-11)18-8-3-6-14(18)16(19)20/h1-2,4-5,7,9-10,14-15H,3,6,8H2,(H,19,20)