2-[2-methyl-1-[4-(2-pyridin-4-ylethoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-[4-(2-pyridin-4-ylethoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-[4-[2-(4-pyridyl)ethoxy]benzoyl]indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-[4-(2-pyridin-4-ylethoxy)phenyl]methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-(2-pyridin-4-ylethoxy)benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-[4-[2-(4-pyridyl)ethoxy]benzoyl]indol-4-yl]acetic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC4=CC=NC=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC4=CC=NC=C4)CC(=O)O

InChI

InChI=1S/C25H22N2O4/c1-17-15-22-20(16-24(28)29)3-2-4-23(22)27(17)25(30)19-5-7-21(8-6-19)31-14-11-18-9-12-26-13-10-18/h2-10,12-13,15H,11,14,16H2,1H3,(H,28,29)