4-[4-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2-methoxy-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(2-methoxy-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoic acid IUPAC Name: 4-[4-(2-methoxy-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[3-keto-4-(2-keto-2-methoxy-ethyl)-1,4-benzoxazin-6-yl]butyric acid Formula: C15H15NO7 MolecularWeight: 321.2821

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CCC(=O)O

Isomeric SMILES

COC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C15H15NO7/c1-22-15(21)7-16-10-6-9(11(17)3-5-14(19)20)2-4-12(10)23-8-13(16)18/h2,4,6H,3,5,7-8H2,1H3,(H,19,20)