4-methyl-6-oxidanylidene-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1H-pyridazine-5-carbonitrile

Systemtic Name: 4-methyl-6-oxidanylidene-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-(3-benzyloxyphenyl)vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 4-methyl-6-oxo-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1H-pyridazine-5-carbonitrile IUPAC Name: 4-methyl-6-oxo-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1H-pyridazine-5-carbonitrile Traditional Name: 3-[(E)-2-(3-benzoxyphenyl)vinyl]-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C=CC2=CC(=CC=C2)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1/C=C/C2=CC(=CC=C2)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H17N3O2/c1-15-19(13-22)21(25)24-23-20(15)11-10-16-8-5-9-18(12-16)26-14-17-6-3-2-4-7-17/h2-12H,14H2,1H3,(H,24,25)/b11-10+