4-methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-oxidanylidene-1H-pyridazine-5-carbonitrile

Systemtic Name: 4-methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-(4-tert-butoxyphenyl)-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 4-methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 4-methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 3-(4-tert-butoxyphenyl)-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C2=CC=C(C=C2)OC(C)(C)C)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1C2=CC=C(C=C2)OC(C)(C)C)C#N

InChI

InChI=1S/C16H17N3O2/c1-10-13(9-17)15(20)19-18-14(10)11-5-7-12(8-6-11)21-16(2,3)4/h5-8H,1-4H3,(H,19,20)