5-bromanyl-2-hexoxy-3-methoxy-benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-hexoxy-3-methoxy-benzenecarbonitrile Openeye Name: 5-bromo-2-hexoxy-3-methoxy-benzonitrile CAS Name: 5-bromo-2-hexoxy-3-methoxybenzonitrile IUPAC Name: 5-bromo-2-hexoxy-3-methoxybenzonitrile Traditional Name: 5-bromo-2-hexoxy-3-methoxy-benzonitrile Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1C#N)Br)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1C#N)Br)OC

InChI

InChI=1S/C14H18BrNO2/c1-3-4-5-6-7-18-14-11(10-16)8-12(15)9-13(14)17-2/h8-9H,3-7H2,1-2H3