3-[6-oxidanylidene-3-(4-propan-2-ylphenyl)pyridazin-1-yl]propanenitrile

Systemtic Name: 3-[6-oxidanylidene-3-(4-propan-2-ylphenyl)pyridazin-1-yl]propanenitrile Openeye Name: 3-[3-(4-isopropylphenyl)-6-oxo-pyridazin-1-yl]propanenitrile CAS Name: 3-[6-oxo-3-(4-propan-2-ylphenyl)-1-pyridazinyl]propanenitrile IUPAC Name: 3-[6-oxo-3-(4-propan-2-ylphenyl)pyridazin-1-yl]propanenitrile Traditional Name: 3-(6-keto-3-p-cumenyl-pyridazin-1-yl)propionitrile Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCC#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCC#N

InChI

InChI=1S/C16H17N3O/c1-12(2)13-4-6-14(7-5-13)15-8-9-16(20)19(18-15)11-3-10-17/h4-9,12H,3,11H2,1-2H3