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

Systemtic Name: 2-[1-[(4-chlorophenyl)methyl]-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid Openeye Name: 2-[1-[(4-chlorophenyl)methyl]-5-(2-quinolylmethoxy)indol-3-yl]acetic acid CAS Name: 2-[1-[(4-chlorophenyl)methyl]-5-(2-quinolinylmethoxy)-3-indolyl]acetic acid IUPAC Name: 2-[1-[(4-chlorophenyl)methyl]-5-(quinolin-2-ylmethoxy)indol-3-yl]acetic acid Traditional Name: 2-[1-(4-chlorobenzyl)-5-(2-quinolylmethoxy)indol-3-yl]acetic acid Formula: C27H21ClN2O3 MolecularWeight: 456.92024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC4=C(C=C3)N(C=C4CC(=O)O)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC4=C(C=C3)N(C=C4CC(=O)O)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H21ClN2O3/c28-21-8-5-18(6-9-21)15-30-16-20(13-27(31)32)24-14-23(11-12-26(24)30)33-17-22-10-7-19-3-1-2-4-25(19)29-22/h1-12,14,16H,13,15,17H2,(H,31,32)