3-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile

Systemtic Name: 3-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 3-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 3-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 6-keto-3-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)vinyl]-4-methyl-1H-pyridazine-5-carbonitrile Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C=CC2=CC3=C(C(=C2)OC)OCCO3)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1/C=C/C2=CC3=C(C(=C2)OC)OCCO3)C#N

InChI

InChI=1S/C17H15N3O4/c1-10-12(9-18)17(21)20-19-13(10)4-3-11-7-14(22-2)16-15(8-11)23-5-6-24-16/h3-4,7-8H,5-6H2,1-2H3,(H,20,21)/b4-3+