2-ethanoyl-4-oxidanylidene-4-(3-propan-2-yloxyphenyl)butanenitrile

Systemtic Name: 2-ethanoyl-4-oxidanylidene-4-(3-propan-2-yloxyphenyl)butanenitrile Openeye Name: 2-acetyl-4-(3-isopropoxyphenyl)-4-oxo-butanenitrile CAS Name: 2-acetyl-4-oxo-4-(3-propan-2-yloxyphenyl)butanenitrile IUPAC Name: 2-acetyl-4-oxo-4-(3-propan-2-yloxyphenyl)butanenitrile Traditional Name: 2-acetyl-4-(3-isopropoxyphenyl)-4-keto-butyronitrile Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)CC(C#N)C(=O)C

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)CC(C#N)C(=O)C

InChI

InChI=1S/C15H17NO3/c1-10(2)19-14-6-4-5-12(7-14)15(18)8-13(9-16)11(3)17/h4-7,10,13H,8H2,1-3H3