N-butyl-2-[[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-butyl-2-[[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: N-butyl-2-[[6-(1,1-dimethylpropyl)-3-oxo-1,4-benzoxazin-4-yl]methyl]oxazole-4-carboxamide CAS Name: N-butyl-2-[[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-4-oxazolecarboxamide IUPAC Name: N-butyl-2-[[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[(6-tert-amyl-3-keto-1,4-benzoxazin-4-yl)methyl]-N-butyl-oxazole-4-carboxamide Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=COC(=N1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)CC

Isomeric SMILES

CCCCNC(=O)C1=COC(=N1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)CC

InChI

InChI=1S/C22H29N3O4/c1-5-7-10-23-21(27)16-13-29-19(24-16)12-25-17-11-15(22(3,4)6-2)8-9-18(17)28-14-20(25)26/h8-9,11,13H,5-7,10,12,14H2,1-4H3,(H,23,27)