(E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridin-3-yl-prop-2-en-1-one

Systemtic Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridin-3-yl-prop-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-pyridyl)prop-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-pyridinyl)-2-propen-1-one IUPAC Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridin-3-ylprop-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-pyridyl)prop-2-en-1-one Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)C=CC3=CN=CC=C3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)/C=C/C3=CN=CC=C3)OC1

InChI

InChI=1S/C17H15NO3/c19-15(6-4-13-3-1-8-18-12-13)14-5-7-16-17(11-14)21-10-2-9-20-16/h1,3-8,11-12H,2,9-10H2/b6-4+