3-butyl-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-butyl-2-oxidanyl-benzenecarbonitrile Openeye Name: 3-butyl-2-hydroxy-benzonitrile CAS Name: 3-butyl-2-hydroxybenzonitrile IUPAC Name: 3-butyl-2-hydroxybenzonitrile Traditional Name: 3-butyl-2-hydroxy-benzonitrile Formula: C11H13NO MolecularWeight: 175.22702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=C1O)C#N

Isomeric SMILES

CCCCC1=CC=CC(=C1O)C#N

InChI

InChI=1S/C11H13NO/c1-2-3-5-9-6-4-7-10(8-12)11(9)13/h4,6-7,13H,2-3,5H2,1H3