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

Systemtic Name: N-butyl-2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-1,3-oxazole-4-carboxamide Openeye Name: N-butyl-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]oxazole-4-carboxamide CAS Name: N-butyl-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-4-oxazolecarboxamide IUPAC Name: N-butyl-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-1,3-oxazole-4-carboxamide Traditional Name: N-butyl-2-[(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)methyl]oxazole-4-carboxamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4/c1-5-6-9-22-20(26)15-12-28-18(23-15)11-24-16-10-14(21(2,3)4)7-8-17(16)27-13-19(24)25/h7-8,10,12H,5-6,9,11,13H2,1-4H3,(H,22,26)