5-(4-bromophenyl)-3-ethyl-pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 5-(4-bromophenyl)-3-ethyl-pyrrolidine-2,4-dicarboxylic acid Openeye Name: 5-(4-bromophenyl)-3-ethyl-pyrrolidine-2,4-dicarboxylic acid CAS Name: 5-(4-bromophenyl)-3-ethylpyrrolidine-2,4-dicarboxylic acid IUPAC Name: 5-(4-bromophenyl)-3-ethylpyrrolidine-2,4-dicarboxylic acid Traditional Name: 5-(4-bromophenyl)-3-ethyl-pyrrolidine-2,4-dicarboxylic acid Formula: C14H16BrNO4 MolecularWeight: 342.18514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(NC1C(=O)O)C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CCC1C(C(NC1C(=O)O)C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C14H16BrNO4/c1-2-9-10(13(17)18)11(16-12(9)14(19)20)7-3-5-8(15)6-4-7/h3-6,9-12,16H,2H2,1H3,(H,17,18)(H,19,20)