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

Systemtic Name: 1-[3-(3-bromophenyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-(3-bromophenyl)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(3-bromophenyl)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-(3-bromophenyl)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(3-bromophenyl)propanoyl]proline Formula: C14H16BrNO3 MolecularWeight: 326.18574

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC2=CC(=CC=C2)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CCC2=CC(=CC=C2)Br)C(=O)O

InChI

InChI=1S/C14H16BrNO3/c15-11-4-1-3-10(9-11)6-7-13(17)16-8-2-5-12(16)14(18)19/h1,3-4,9,12H,2,5-8H2,(H,18,19)