(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2,6-dimethylquinoline-4-carboxylate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=NC(=NO3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=NC(=NO3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H17N3O3/c1-13-8-9-18-16(10-13)17(11-14(2)22-18)21(25)26-12-19-23-20(24-27-19)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3