2-[5-bromanyl-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-bromanyl-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxyphenyl)-5-bromo-1H-indol-3-yl]acetic acid CAS Name: 2-[5-bromo-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-bromo-2-(4-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxyphenyl)-5-bromo-1H-indol-3-yl]acetic acid Formula: C23H18BrNO3 MolecularWeight: 436.29792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C4=C(N3)C=CC(=C4)Br)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C4=C(N3)C=CC(=C4)Br)CC(=O)O

InChI

InChI=1S/C23H18BrNO3/c24-17-8-11-21-19(12-17)20(13-22(26)27)23(25-21)16-6-9-18(10-7-16)28-14-15-4-2-1-3-5-15/h1-12,25H,13-14H2,(H,26,27)