2-[1-[(4-bromophenyl)methyl]-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid Openeye Name: 2-[1-[(4-bromophenyl)methyl]-2-methyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid CAS Name: 2-[1-[(4-bromophenyl)methyl]-2-methyl-5-(2-quinolinylmethoxy)-3-indolyl]acetic acid IUPAC Name: 2-[1-[(4-bromophenyl)methyl]-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]acetic acid Traditional Name: 2-[1-(4-bromobenzyl)-2-methyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid Formula: C28H23BrN2O3 MolecularWeight: 515.39782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

InChI

InChI=1S/C28H23BrN2O3/c1-18-24(15-28(32)33)25-14-23(34-17-22-11-8-20-4-2-3-5-26(20)30-22)12-13-27(25)31(18)16-19-6-9-21(29)10-7-19/h2-14H,15-17H2,1H3,(H,32,33)