3-methyl-5-[5-methyl-2,4-bis(oxidanylidene)hexan-3-yl]oxy-benzenecarbonitrile

Systemtic Name: 3-methyl-5-[5-methyl-2,4-bis(oxidanylidene)hexan-3-yl]oxy-benzenecarbonitrile Openeye Name: 3-(1-acetyl-3-methyl-2-oxo-butoxy)-5-methyl-benzonitrile CAS Name: 3-methyl-5-(5-methyl-2,4-dioxohexan-3-yl)oxybenzonitrile IUPAC Name: 3-methyl-5-(5-methyl-2,4-dioxohexan-3-yl)oxybenzonitrile Traditional Name: 3-(1-acetyl-2-keto-3-methyl-butoxy)-5-methyl-benzonitrile Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)OC(C(=O)C)C(=O)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)OC(C(=O)C)C(=O)C(C)C

InChI

InChI=1S/C15H17NO3/c1-9(2)14(18)15(11(4)17)19-13-6-10(3)5-12(7-13)8-16/h5-7,9,15H,1-4H3