3-bromanyl-5-methoxy-4-propoxy-benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-methoxy-4-propoxy-benzenecarbonitrile Openeye Name: 3-bromo-5-methoxy-4-propoxy-benzonitrile CAS Name: 3-bromo-5-methoxy-4-propoxybenzonitrile IUPAC Name: 3-bromo-5-methoxy-4-propoxybenzonitrile Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzonitrile Formula: C11H12BrNO2 MolecularWeight: 270.12248

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C#N)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C#N)OC

InChI

InChI=1S/C11H12BrNO2/c1-3-4-15-11-9(12)5-8(7-13)6-10(11)14-2/h5-6H,3-4H2,1-2H3