3-(1-oxidanylidenepropan-2-yl)benzenecarbonitrile

Systemtic Name: 3-(1-oxidanylidenepropan-2-yl)benzenecarbonitrile Openeye Name: 3-(1-methyl-2-oxo-ethyl)benzonitrile CAS Name: 3-(1-oxopropan-2-yl)benzonitrile IUPAC Name: 3-(1-oxopropan-2-yl)benzonitrile Traditional Name: 3-(2-keto-1-methyl-ethyl)benzonitrile Formula: C10H9NO MolecularWeight: 159.18456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO/c1-8(7-12)10-4-2-3-9(5-10)6-11/h2-5,7-8H,1H3