2-[6-oxidanylidene-3-(2,4,5-trimethylphenyl)pyridazin-1-yl]ethanenitrile

Systemtic Name: 2-[6-oxidanylidene-3-(2,4,5-trimethylphenyl)pyridazin-1-yl]ethanenitrile Openeye Name: 2-[6-oxo-3-(2,4,5-trimethylphenyl)pyridazin-1-yl]acetonitrile CAS Name: 2-[6-oxo-3-(2,4,5-trimethylphenyl)-1-pyridazinyl]acetonitrile IUPAC Name: 2-[6-oxo-3-(2,4,5-trimethylphenyl)pyridazin-1-yl]acetonitrile Traditional Name: 2-[6-keto-3-(2,4,5-trimethylphenyl)pyridazin-1-yl]acetonitrile Formula: C15H15N3O MolecularWeight: 253.2991

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O/c1-10-8-12(3)13(9-11(10)2)14-4-5-15(19)18(17-14)7-6-16/h4-5,8-9H,7H2,1-3H3