4-[4-[2-[3-(methylamino)pyridin-2-yl]ethoxy]phenyl]-3-thiophen-2-yl-butanoic acid

Systemtic Name: 4-[4-[2-[3-(methylamino)pyridin-2-yl]ethoxy]phenyl]-3-thiophen-2-yl-butanoic acid Openeye Name: 4-[4-[2-[3-(methylamino)-2-pyridyl]ethoxy]phenyl]-3-(2-thienyl)butanoic acid CAS Name: 4-[4-[2-[3-(methylamino)-2-pyridinyl]ethoxy]phenyl]-3-thiophen-2-ylbutanoic acid IUPAC Name: 4-[4-[2-[3-(methylamino)pyridin-2-yl]ethoxy]phenyl]-3-thiophen-2-ylbutanoic acid Traditional Name: 4-[4-[2-[3-(methylamino)-2-pyridyl]ethoxy]phenyl]-3-(2-thienyl)butyric acid Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(N=CC=C1)CCOC2=CC=C(C=C2)CC(CC(=O)O)C3=CC=CS3

Isomeric SMILES

CNC1=C(N=CC=C1)CCOC2=CC=C(C=C2)CC(CC(=O)O)C3=CC=CS3

InChI

InChI=1S/C22H24N2O3S/c1-23-19-4-2-11-24-20(19)10-12-27-18-8-6-16(7-9-18)14-17(15-22(25)26)21-5-3-13-28-21/h2-9,11,13,17,23H,10,12,14-15H2,1H3,(H,25,26)