3-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]-1H-indole-5-carboxylic acid

Systemtic Name: 3-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[[4-(2-quinolylmethoxy)phenyl]methyl]-1H-indole-5-carboxylic acid CAS Name: 3-[[4-(2-quinolinylmethoxy)phenyl]methyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[4-(2-quinolylmethoxy)benzyl]-1H-indole-5-carboxylic acid Formula: C26H20N2O3 MolecularWeight: 408.4486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)CC4=CNC5=C4C=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)CC4=CNC5=C4C=C(C=C5)C(=O)O

InChI

InChI=1S/C26H20N2O3/c29-26(30)19-8-12-25-23(14-19)20(15-27-25)13-17-5-10-22(11-6-17)31-16-21-9-7-18-3-1-2-4-24(18)28-21/h1-12,14-15,27H,13,16H2,(H,29,30)