5-bromanyl-2-hexoxy-benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-hexoxy-benzenecarbonitrile Openeye Name: 5-bromo-2-hexoxy-benzonitrile CAS Name: 5-bromo-2-hexoxybenzonitrile IUPAC Name: 5-bromo-2-hexoxybenzonitrile Traditional Name: 5-bromo-2-hexoxy-benzonitrile Formula: C13H16BrNO MolecularWeight: 282.17624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C#N

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C#N

InChI

InChI=1S/C13H16BrNO/c1-2-3-4-5-8-16-13-7-6-12(14)9-11(13)10-15/h6-7,9H,2-5,8H2,1H3