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

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic 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=CC3=C(ON=C3C=C2)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

InChI

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