5-bromanyl-2-prop-2-enyl-benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-prop-2-enyl-benzenecarbonitrile Openeye Name: 2-allyl-5-bromo-benzonitrile CAS Name: 5-bromo-2-prop-2-enylbenzonitrile IUPAC Name: 5-bromo-2-prop-2-enylbenzonitrile Traditional Name: 2-allyl-5-bromo-benzonitrile Formula: C10H8BrN MolecularWeight: 222.08122

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=C(C=C1)Br)C#N

Isomeric SMILES

C=CCC1=C(C=C(C=C1)Br)C#N

InChI

InChI=1S/C10H8BrN/c1-2-3-8-4-5-10(11)6-9(8)7-12/h2,4-6H,1,3H2