3-methyl-5-[(E)-3-oxidanylprop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-methyl-5-[(E)-3-oxidanylprop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-hydroxyprop-1-enyl]-5-methyl-benzonitrile CAS Name: 3-[(E)-3-hydroxyprop-1-enyl]-5-methylbenzonitrile IUPAC Name: 3-[(E)-3-hydroxyprop-1-enyl]-5-methylbenzonitrile Traditional Name: 3-[(E)-3-hydroxyprop-1-enyl]-5-methyl-benzonitrile Formula: C11H11NO MolecularWeight: 173.21114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C=CCO)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)/C=C/CO)C#N

InChI

InChI=1S/C11H11NO/c1-9-5-10(3-2-4-13)7-11(6-9)8-12/h2-3,5-7,13H,4H2,1H3/b3-2+