1-cyanoethyl 2-bromanyl-5-methoxy-benzoate

Systemtic Name: 1-cyanoethyl 2-bromanyl-5-methoxy-benzoate Openeye Name: 1-cyanoethyl 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid 1-cyanoethyl ester Formula: C11H10BrNO3 MolecularWeight: 284.106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=C(C=CC(=C1)OC)Br

Isomeric SMILES

CC(C#N)OC(=O)C1=C(C=CC(=C1)OC)Br

InChI

InChI=1S/C11H10BrNO3/c1-7(6-13)16-11(14)9-5-8(15-2)3-4-10(9)12/h3-5,7H,1-2H3