4-oxidanylidene-4-[3-oxidanylidene-4-[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-1,4-benzoxazin-6-yl]butanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCC(=O)O

Isomeric SMILES

C[C@@H](C(=O)O)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C15H15NO7/c1-8(15(21)22)16-10-6-9(11(17)3-5-14(19)20)2-4-12(10)23-7-13(16)18/h2,4,6,8H,3,5,7H2,1H3,(H,19,20)(H,21,22)/t8-/m0/s1