2-[(2S)-2,6-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: 2-[(2S)-2,6-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: 2-[(2S)-2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl]acetate IUPAC Name: 2-[(2S)-2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-3-keto-2,6-dimethyl-1,4-benzoxazin-4-yl]acetate Formula: C12H12NO4- MolecularWeight: 234.22798

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(=O)[O-]

Isomeric SMILES

C[C@H]1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-7-3-4-10-9(5-7)13(6-11(14)15)12(16)8(2)17-10/h3-5,8H,6H2,1-2H3,(H,14,15)/p-1/t8-/m0/s1