2-[(2S)-6-(3-azanyloxy-3-oxidanylidene-propyl)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-6-(3-azanyloxy-3-oxidanylidene-propyl)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2S)-6-(3-aminooxy-3-oxo-propyl)-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2S)-6-(3-aminooxy-3-oxopropyl)-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2S)-6-(3-aminooxy-3-oxopropyl)-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2S)-6-(3-aminooxy-3-keto-propyl)-3-keto-4H-1,4-benzoxazin-2-yl]acetic acid Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCC(=O)ON)NC(=O)C(O2)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1CCC(=O)ON)NC(=O)[C@@H](O2)CC(=O)O

InChI

InChI=1S/C13H14N2O6/c14-21-12(18)4-2-7-1-3-9-8(5-7)15-13(19)10(20-9)6-11(16)17/h1,3,5,10H,2,4,6,14H2,(H,15,19)(H,16,17)/t10-/m0/s1