2-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate

Systemtic Name: 2-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate Openeye Name: 2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)butanoate CAS Name: 2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)butanoate IUPAC Name: 2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)butanoate Traditional Name: 2-(3-keto-2-methyl-1,4-benzoxazin-4-yl)butyrate Formula: C13H14NO4- MolecularWeight: 248.25456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C2=CC=CC=C2OC(C1=O)C

Isomeric SMILES

CCC(C(=O)[O-])N1C2=CC=CC=C2OC(C1=O)C

InChI

InChI=1S/C13H15NO4/c1-3-9(13(16)17)14-10-6-4-5-7-11(10)18-8(2)12(14)15/h4-9H,3H2,1-2H3,(H,16,17)/p-1