1-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-bromo-3,4,5-trimethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(2-bromo-3,4,5-trimethoxy-benzyl)proline Formula: C15H20BrNO5 MolecularWeight: 374.227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)CN2CCCC2C(=O)O)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)CN2CCCC2C(=O)O)Br)OC)OC

InChI

InChI=1S/C15H20BrNO5/c1-20-11-7-9(12(16)14(22-3)13(11)21-2)8-17-6-4-5-10(17)15(18)19/h7,10H,4-6,8H2,1-3H3,(H,18,19)