(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-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-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O3/c1-3-17-14(2)20(16-11-7-8-12-18(16)23-17)22(26)27-13-19-24-21(25-28-19)15-9-5-4-6-10-15/h4-12H,3,13H2,1-2H3