3-ethanoyl-4-oxidanyl-cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 3-ethanoyl-4-oxidanyl-cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 3-acetyl-4-hydroxy-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 3-acetyl-4-hydroxy-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 3-acetyl-4-hydroxycyclohexa-1,3-diene-1-carbonitrile Traditional Name: 3-acetyl-4-hydroxy-cyclohexa-1,3-diene-1-carbonitrile Formula: C9H9NO2 MolecularWeight: 163.17326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO2/c1-6(11)8-4-7(5-10)2-3-9(8)12/h4,12H,2-3H2,1H3