methyl 3-bromanyl-4-(diethylamino)benzoate

Systemtic Name: methyl 3-bromanyl-4-(diethylamino)benzoate Openeye Name: methyl 3-bromo-4-(diethylamino)benzoate CAS Name: 3-bromo-4-(diethylamino)benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-(diethylamino)benzoate Traditional Name: 3-bromo-4-(diethylamino)benzoic acid methyl ester Formula: C12H16BrNO2 MolecularWeight: 286.16494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C(=O)OC)Br

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)C(=O)OC)Br

InChI

InChI=1S/C12H16BrNO2/c1-4-14(5-2)11-7-6-9(8-10(11)13)12(15)16-3/h6-8H,4-5H2,1-3H3