benzoic acid; 1,2-bis(bromanyl)ethyl 1-oxidanylpyrrolidine-2-carboxylate

Systemtic Name: benzoic acid; 1,2-bis(bromanyl)ethyl 1-oxidanylpyrrolidine-2-carboxylate Openeye Name: benzoic acid; 1,2-dibromoethyl 1-hydroxypyrrolidine-2-carboxylate CAS Name: benzoic acid; 1-hydroxy-2-pyrrolidinecarboxylic acid 1,2-dibromoethyl ester IUPAC Name: benzoic acid; 1,2-dibromoethyl 1-hydroxypyrrolidine-2-carboxylate Traditional Name: benzoic acid; 1-hydroxypyrrolidine-2-carboxylic acid 1,2-dibromoethyl ester Formula: C14H17Br2NO5 MolecularWeight: 439.09648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)O)C(=O)OC(CBr)Br.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

C1CC(N(C1)O)C(=O)OC(CBr)Br.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C7H11Br2NO3.C7H6O2/c8-4-6(9)13-7(11)5-2-1-3-10(5)12;8-7(9)6-4-2-1-3-5-6/h5-6,12H,1-4H2;1-5H,(H,8,9)