(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]prop-2-enamide Openeye Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]prop-2-enamide CAS Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-2-propenamide IUPAC Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]prop-2-enamide Traditional Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]acrylamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C=CC(=O)NCC3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)/C=C/C(=O)NCC3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C21H20N4O4/c1-27-17-12-15(13-18-20(17)29-11-10-28-18)5-6-19(26)23-14-16-4-2-7-22-21(16)25-9-3-8-24-25/h2-9,12-13H,10-11,14H2,1H3,(H,23,26)/b6-5+