3-bromanyl-4-(cyanomethoxy)-5-ethoxy-benzoic acid

Systemtic Name: 3-bromanyl-4-(cyanomethoxy)-5-ethoxy-benzoic acid Openeye Name: 3-bromo-4-(cyanomethoxy)-5-ethoxy-benzoic acid CAS Name: 3-bromo-4-(cyanomethoxy)-5-ethoxybenzoic acid IUPAC Name: 3-bromo-4-(cyanomethoxy)-5-ethoxybenzoic acid Traditional Name: 3-bromo-4-(cyanomethoxy)-5-ethoxy-benzoic acid Formula: C11H10BrNO4 MolecularWeight: 300.1054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrNO4/c1-2-16-9-6-7(11(14)15)5-8(12)10(9)17-4-3-13/h5-6H,2,4H2,1H3,(H,14,15)