2,1,3-benzoxadiazol-5-ylmethyl 2-methylquinoline-4-carboxylate

Systemtic Name: 2,1,3-benzoxadiazol-5-ylmethyl 2-methylquinoline-4-carboxylate Openeye Name: 2,1,3-benzoxadiazol-5-ylmethyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid 2,1,3-benzoxadiazol-5-ylmethyl ester IUPAC Name: 2,1,3-benzoxadiazol-5-ylmethyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid benzofurazan-5-ylmethyl ester Formula: C18H13N3O3 MolecularWeight: 319.31412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC4=NON=C4C=C3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC4=NON=C4C=C3

InChI

InChI=1S/C18H13N3O3/c1-11-8-14(13-4-2-3-5-15(13)19-11)18(22)23-10-12-6-7-16-17(9-12)21-24-20-16/h2-9H,10H2,1H3