3-bromanyl-5-chloranyl-2-pentoxy-benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-chloranyl-2-pentoxy-benzenecarbonitrile Openeye Name: 3-bromo-5-chloro-2-pentoxy-benzonitrile CAS Name: 3-bromo-5-chloro-2-pentoxybenzonitrile IUPAC Name: 3-bromo-5-chloro-2-pentoxybenzonitrile Traditional Name: 2-amoxy-3-bromo-5-chloro-benzonitrile Formula: C12H13BrClNO MolecularWeight: 302.59472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1C#N)Cl)Br

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1C#N)Cl)Br

InChI

InChI=1S/C12H13BrClNO/c1-2-3-4-5-16-12-9(8-15)6-10(14)7-11(12)13/h6-7H,2-5H2,1H3