2-[4-(4-bromophenyl)-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]ethanoic acid

Systemtic Name: 2-[4-(4-bromophenyl)-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]ethanoic acid Openeye Name: 2-[4-(4-bromophenyl)-1-[4-(2-quinolylmethoxy)phenyl]butoxy]acetic acid CAS Name: 2-[4-(4-bromophenyl)-1-[4-(2-quinolinylmethoxy)phenyl]butoxy]acetic acid IUPAC Name: 2-[4-(4-bromophenyl)-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]acetic acid Traditional Name: 2-[4-(4-bromophenyl)-1-[4-(2-quinolylmethoxy)phenyl]butoxy]acetic acid Formula: C28H26BrNO4 MolecularWeight: 520.41434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)C(CCCC4=CC=C(C=C4)Br)OCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)C(CCCC4=CC=C(C=C4)Br)OCC(=O)O

InChI

InChI=1S/C28H26BrNO4/c29-23-13-8-20(9-14-23)4-3-7-27(34-19-28(31)32)22-11-16-25(17-12-22)33-18-24-15-10-21-5-1-2-6-26(21)30-24/h1-2,5-6,8-17,27H,3-4,7,18-19H2,(H,31,32)