4-(1-oxidanylidenepropan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(1-oxidanylidenepropan-2-yl)benzenecarbonitrile Openeye Name: 4-(1-methyl-2-oxo-ethyl)benzonitrile CAS Name: 4-(1-oxopropan-2-yl)benzonitrile IUPAC Name: 4-(1-oxopropan-2-yl)benzonitrile Traditional Name: 4-(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=C(C=C1)C#N

Isomeric SMILES

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

InChI

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