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

Systemtic Name: 4-[4-[2-[3-(methylamino)pyridin-2-yl]ethoxy]phenyl]butanoic acid Openeye Name: 4-[4-[2-[3-(methylamino)-2-pyridyl]ethoxy]phenyl]butanoic acid CAS Name: 4-[4-[2-[3-(methylamino)-2-pyridinyl]ethoxy]phenyl]butanoic acid IUPAC Name: 4-[4-[2-[3-(methylamino)pyridin-2-yl]ethoxy]phenyl]butanoic acid Traditional Name: 4-[4-[2-[3-(methylamino)-2-pyridyl]ethoxy]phenyl]butyric acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(N=CC=C1)CCOC2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

CNC1=C(N=CC=C1)CCOC2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C18H22N2O3/c1-19-16-5-3-12-20-17(16)11-13-23-15-9-7-14(8-10-15)4-2-6-18(21)22/h3,5,7-10,12,19H,2,4,6,11,13H2,1H3,(H,21,22)