1-[2,2-bis(oxidanyl)ethyl]cyclohexa-2,5-diene-1-carbonitrile

Systemtic Name: 1-[2,2-bis(oxidanyl)ethyl]cyclohexa-2,5-diene-1-carbonitrile Openeye Name: 1-(2,2-dihydroxyethyl)cyclohexa-2,5-diene-1-carbonitrile CAS Name: 1-(2,2-dihydroxyethyl)-1-cyclohexa-2,5-dienecarbonitrile IUPAC Name: 1-(2,2-dihydroxyethyl)cyclohexa-2,5-diene-1-carbonitrile Traditional Name: 1-(2,2-dihydroxyethyl)cyclohexa-2,5-diene-1-carbonitrile Formula: C9H11NO2 MolecularWeight: 165.18914

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C=C1)(CC(O)O)C#N

Isomeric SMILES

C1C=CC(C=C1)(CC(O)O)C#N

InChI

InChI=1S/C9H11NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h2-5,8,11-12H,1,6H2