6-(3-methylbut-1-ynyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 6-(3-methylbut-1-ynyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-6-(3-methylbut-1-ynyl)pyridazin-3-one CAS Name: 6-(3-methylbut-1-ynyl)-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-(3-methylbut-1-ynyl)pyridazin-3-one Traditional Name: 2-benzyl-6-(3-methylbut-1-ynyl)pyridazin-3-one Formula: C16H16N2O MolecularWeight: 252.31104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC1=NN(C(=O)C=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C#CC1=NN(C(=O)C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H16N2O/c1-13(2)8-9-15-10-11-16(19)18(17-15)12-14-6-4-3-5-7-14/h3-7,10-11,13H,12H2,1-2H3