5-ethanoyl-2-ethyl-benzenecarbonitrile

Systemtic Name: 5-ethanoyl-2-ethyl-benzenecarbonitrile Openeye Name: 5-acetyl-2-ethyl-benzonitrile CAS Name: 5-acetyl-2-ethylbenzonitrile IUPAC Name: 5-acetyl-2-ethylbenzonitrile Traditional Name: 5-acetyl-2-ethyl-benzonitrile Formula: C11H11NO MolecularWeight: 173.21114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)C)C#N

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)C)C#N

InChI

InChI=1S/C11H11NO/c1-3-9-4-5-10(8(2)13)6-11(9)7-12/h4-6H,3H2,1-2H3