[5,7-bis(bromanyl)quinolin-8-yl] 2-methylbenzoate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 2-methylbenzoate Openeye Name: (5,7-dibromo-8-quinolyl) 2-methylbenzoate CAS Name: 2-methylbenzoic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 2-methylbenzoate Traditional Name: 2-methylbenzoic acid (5,7-dibromo-8-quinolyl) ester Formula: C17H11Br2NO2 MolecularWeight: 421.08274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br

InChI

InChI=1S/C17H11Br2NO2/c1-10-5-2-3-6-11(10)17(21)22-16-14(19)9-13(18)12-7-4-8-20-15(12)16/h2-9H,1H3