2-[(2R)-2-ethyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)NC2=C(O1)C=CC(=C2)CC(=O)[O-]

Isomeric SMILES

CC[C@@H]1C(=O)NC2=C(O1)C=CC(=C2)CC(=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-2-9-12(16)13-8-5-7(6-11(14)15)3-4-10(8)17-9/h3-5,9H,2,6H2,1H3,(H,13,16)(H,14,15)/p-1/t9-/m1/s1