2-[2-bromanyl-4-(quinolin-2-ylmethoxy)phenyl]-2-cyclopentyl-ethanoic acid

Systemtic Name: 2-[2-bromanyl-4-(quinolin-2-ylmethoxy)phenyl]-2-cyclopentyl-ethanoic acid Openeye Name: 2-[2-bromo-4-(2-quinolylmethoxy)phenyl]-2-cyclopentyl-acetic acid CAS Name: 2-[2-bromo-4-(2-quinolinylmethoxy)phenyl]-2-cyclopentylacetic acid IUPAC Name: 2-[2-bromo-4-(quinolin-2-ylmethoxy)phenyl]-2-cyclopentylacetic acid Traditional Name: 2-[2-bromo-4-(2-quinolylmethoxy)phenyl]-2-cyclopentyl-acetic acid Formula: C23H22BrNO3 MolecularWeight: 440.32968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)Br)C(=O)O

Isomeric SMILES

C1CCC(C1)C(C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)Br)C(=O)O

InChI

InChI=1S/C23H22BrNO3/c24-20-13-18(11-12-19(20)22(23(26)27)16-6-1-2-7-16)28-14-17-10-9-15-5-3-4-8-21(15)25-17/h3-5,8-13,16,22H,1-2,6-7,14H2,(H,26,27)