(E)-1-(1,3-benzodioxol-5-yl)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-3-[4-(2-pyridylmethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-3-[4-(2-pyridinylmethoxy)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-3-[4-(2-pyridylmethoxy)phenyl]prop-2-en-1-one Formula: C22H17NO4 MolecularWeight: 359.37468

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C=CC3=CC=C(C=C3)OCC4=CC=CC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)/C=C/C3=CC=C(C=C3)OCC4=CC=CC=N4

InChI

InChI=1S/C22H17NO4/c24-20(17-7-11-21-22(13-17)27-15-26-21)10-6-16-4-8-19(9-5-16)25-14-18-3-1-2-12-23-18/h1-13H,14-15H2/b10-6+