(E)-3-[[3-(2-ethoxyphenoxy)-2-oxidanyl-propyl]amino]-1-pyridin-3-yl-but-2-en-1-one

Systemtic Name: (E)-3-[[3-(2-ethoxyphenoxy)-2-oxidanyl-propyl]amino]-1-pyridin-3-yl-but-2-en-1-one Openeye Name: (E)-3-[[3-(2-ethoxyphenoxy)-2-hydroxy-propyl]amino]-1-(3-pyridyl)but-2-en-1-one CAS Name: (E)-3-[[3-(2-ethoxyphenoxy)-2-hydroxypropyl]amino]-1-(3-pyridinyl)-2-buten-1-one IUPAC Name: (E)-3-[[3-(2-ethoxyphenoxy)-2-hydroxypropyl]amino]-1-pyridin-3-ylbut-2-en-1-one Traditional Name: (E)-3-[[3-(2-ethoxyphenoxy)-2-hydroxy-propyl]amino]-1-(3-pyridyl)but-2-en-1-one Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCC(CNC(=CC(=O)C2=CN=CC=C2)C)O

Isomeric SMILES

CCOC1=CC=CC=C1OCC(CN/C(=C/C(=O)C2=CN=CC=C2)/C)O

InChI

InChI=1S/C20H24N2O4/c1-3-25-19-8-4-5-9-20(19)26-14-17(23)13-22-15(2)11-18(24)16-7-6-10-21-12-16/h4-12,17,22-23H,3,13-14H2,1-2H3/b15-11+