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

Systemtic Name: methyl 4-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)butanoate Openeye Name: methyl 4-(3-oxo-4H-1,4-benzoxazin-2-yl)butanoate CAS Name: 4-(3-oxo-4H-1,4-benzoxazin-2-yl)butanoic acid methyl ester IUPAC Name: methyl 4-(3-oxo-4H-1,4-benzoxazin-2-yl)butanoate Traditional Name: 4-(3-keto-4H-1,4-benzoxazin-2-yl)butyric acid methyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1C(=O)NC2=CC=CC=C2O1

Isomeric SMILES

COC(=O)CCCC1C(=O)NC2=CC=CC=C2O1

InChI

InChI=1S/C13H15NO4/c1-17-12(15)8-4-7-11-13(16)14-9-5-2-3-6-10(9)18-11/h2-3,5-6,11H,4,7-8H2,1H3,(H,14,16)