[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 7-methoxy-2-methyl-quinoline-3-carboxylate

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 7-methoxy-2-methyl-quinoline-3-carboxylate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 7-methoxy-2-methyl-quinoline-3-carboxylate CAS Name: 7-methoxy-2-methyl-3-quinolinecarboxylic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 7-methoxy-2-methylquinoline-3-carboxylate Traditional Name: 7-methoxy-2-methyl-quinoline-3-carboxylic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H16BrN3O4 MolecularWeight: 454.27344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)OCC3=NN=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)OCC3=NN=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O4/c1-12-17(9-14-5-8-16(27-2)10-18(14)23-12)21(26)28-11-19-24-25-20(29-19)13-3-6-15(22)7-4-13/h3-10H,11H2,1-2H3