tert-butyl 4-[6-(2,2-dimethylbutanoyloxy)quinolin-2-yl]-5-methyl-1,2-oxazole-3-carboxylate

Systemtic Name: tert-butyl 4-[6-(2,2-dimethylbutanoyloxy)quinolin-2-yl]-5-methyl-1,2-oxazole-3-carboxylate Openeye Name: tert-butyl 4-[6-(2,2-dimethylbutanoyloxy)-2-quinolyl]-5-methyl-isoxazole-3-carboxylate CAS Name: 4-[6-(2,2-dimethyl-1-oxobutoxy)-2-quinolinyl]-5-methyl-3-isoxazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-(2,2-dimethylbutanoyloxy)quinolin-2-yl]-5-methyl-1,2-oxazole-3-carboxylate Traditional Name: 4-[6-(2,2-dimethylbutanoyloxy)-2-quinolyl]-5-methyl-isoxazole-3-carboxylic acid tert-butyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OC1=CC2=C(C=C1)N=C(C=C2)C3=C(ON=C3C(=O)OC(C)(C)C)C

Isomeric SMILES

CCC(C)(C)C(=O)OC1=CC2=C(C=C1)N=C(C=C2)C3=C(ON=C3C(=O)OC(C)(C)C)C

InChI

InChI=1S/C24H28N2O5/c1-8-24(6,7)22(28)29-16-10-12-17-15(13-16)9-11-18(25-17)19-14(2)31-26-20(19)21(27)30-23(3,4)5/h9-13H,8H2,1-7H3