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

Systemtic Name: 3-[(E)-2-(7-chloranyl-1,3-benzodioxol-5-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 3-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 3-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 3-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)vinyl]-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C15H10ClN3O3 MolecularWeight: 315.7112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C=CC2=CC3=C(C(=C2)Cl)OCO3)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1/C=C/C2=CC3=C(C(=C2)Cl)OCO3)C#N

InChI

InChI=1S/C15H10ClN3O3/c1-8-10(6-17)15(20)19-18-12(8)3-2-9-4-11(16)14-13(5-9)21-7-22-14/h2-5H,7H2,1H3,(H,19,20)/b3-2+