1-[(5-bromanyl-2-ethoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-bromanyl-2-ethoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-ethoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-ethoxyphenyl)-phenylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-bromo-2-ethoxyphenyl)-phenylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-ethoxy-phenyl)-phenyl-methyl]proline Formula: C20H22BrNO3 MolecularWeight: 404.29758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2)N3CCCC3C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2)N3CCCC3C(=O)O

InChI

InChI=1S/C20H22BrNO3/c1-2-25-18-11-10-15(21)13-16(18)19(14-7-4-3-5-8-14)22-12-6-9-17(22)20(23)24/h3-5,7-8,10-11,13,17,19H,2,6,9,12H2,1H3,(H,23,24)