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

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-phenylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-phenylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-phenyl-methyl]proline Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C2=CC=CC=C2)N3CCCC3C(=O)O)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C2=CC=CC=C2)N3CCCC3C(=O)O)Br)OC

InChI

InChI=1S/C20H22BrNO4/c1-25-17-11-14(15(21)12-18(17)26-2)19(13-7-4-3-5-8-13)22-10-6-9-16(22)20(23)24/h3-5,7-8,11-12,16,19H,6,9-10H2,1-2H3,(H,23,24)