5-hexoxy-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 5-hexoxy-2-oxidanyl-benzenecarbonitrile Openeye Name: 5-hexoxy-2-hydroxy-benzonitrile CAS Name: 5-hexoxy-2-hydroxybenzonitrile IUPAC Name: 5-hexoxy-2-hydroxybenzonitrile Traditional Name: 5-hexoxy-2-hydroxy-benzonitrile Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1)O)C#N

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1)O)C#N

InChI

InChI=1S/C13H17NO2/c1-2-3-4-5-8-16-12-6-7-13(15)11(9-12)10-14/h6-7,9,15H,2-5,8H2,1H3