2-ethanoyl-4-(3-methoxyphenyl)-4-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanoyl-4-(3-methoxyphenyl)-4-oxidanylidene-butanenitrile Openeye Name: 2-acetyl-4-(3-methoxyphenyl)-4-oxo-butanenitrile CAS Name: 2-acetyl-4-(3-methoxyphenyl)-4-oxobutanenitrile IUPAC Name: 2-acetyl-4-(3-methoxyphenyl)-4-oxobutanenitrile Traditional Name: 2-acetyl-4-keto-4-(3-methoxyphenyl)butyronitrile Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c1-9(15)11(8-14)7-13(16)10-4-3-5-12(6-10)17-2/h3-6,11H,7H2,1-2H3