4-(2-bromanyl-6-ethoxy-4-methanoyl-phenoxy)butanenitrile

Systemtic Name: 4-(2-bromanyl-6-ethoxy-4-methanoyl-phenoxy)butanenitrile Openeye Name: 4-(2-bromo-6-ethoxy-4-formyl-phenoxy)butanenitrile CAS Name: 4-(2-bromo-6-ethoxy-4-formylphenoxy)butanenitrile IUPAC Name: 4-(2-bromo-6-ethoxy-4-formylphenoxy)butanenitrile Traditional Name: 4-(2-bromo-6-ethoxy-4-formyl-phenoxy)butyronitrile Formula: C13H14BrNO3 MolecularWeight: 312.15916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=O)Br)OCCCC#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=O)Br)OCCCC#N

InChI

InChI=1S/C13H14BrNO3/c1-2-17-12-8-10(9-16)7-11(14)13(12)18-6-4-3-5-15/h7-9H,2-4,6H2,1H3