[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 2-(furan-2-yl)quinoline-4-carboxylate

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 2-(furan-2-yl)quinoline-4-carboxylate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 2-(2-furyl)quinoline-4-carboxylate CAS Name: 2-(2-furanyl)-4-quinolinecarboxylic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 2-(furan-2-yl)quinoline-4-carboxylate Traditional Name: 2-(2-furyl)cinchoninic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C21H19N3O4/c1-13(2)10-19-23-20(28-24-19)12-27-21(25)15-11-17(18-8-5-9-26-18)22-16-7-4-3-6-14(15)16/h3-9,11,13H,10,12H2,1-2H3