1-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,5-dibromo-2-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,5-dibromo-2-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,5-dibromo-2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(3,5-dibromo-2-methoxy-benzyl)proline Formula: C13H15Br2NO3 MolecularWeight: 393.0711

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CN2CCCC2C(=O)O)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1CN2CCCC2C(=O)O)Br)Br

InChI

InChI=1S/C13H15Br2NO3/c1-19-12-8(5-9(14)6-10(12)15)7-16-4-2-3-11(16)13(17)18/h5-6,11H,2-4,7H2,1H3,(H,17,18)