2-[2-methyl-1-[4-(2-pyridin-3-ylethoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-[4-(2-pyridin-3-ylethoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-[4-[2-(3-pyridyl)ethoxy]benzoyl]indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-[4-[2-(3-pyridinyl)ethoxy]phenyl]methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-(2-pyridin-3-ylethoxy)benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-[4-[2-(3-pyridyl)ethoxy]benzoyl]indol-4-yl]acetic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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