4-(2-ethyl-1-oxidanyl-but-3-enyl)benzenecarbonitrile

Systemtic Name: 4-(2-ethyl-1-oxidanyl-but-3-enyl)benzenecarbonitrile Openeye Name: 4-(2-ethyl-1-hydroxy-but-3-enyl)benzonitrile CAS Name: 4-(2-ethyl-1-hydroxybut-3-enyl)benzonitrile IUPAC Name: 4-(2-ethyl-1-hydroxybut-3-enyl)benzonitrile Traditional Name: 4-(2-ethyl-1-hydroxy-but-3-enyl)benzonitrile Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-3-11(4-2)13(15)12-7-5-10(9-14)6-8-12/h3,5-8,11,13,15H,1,4H2,2H3