2-ethoxy-5-ethyl-3,1-benzoxazin-4-one; sulfuric acid

Systemtic Name: 2-ethoxy-5-ethyl-3,1-benzoxazin-4-one; sulfuric acid Openeye Name: 2-ethoxy-5-ethyl-3,1-benzoxazin-4-one; sulfuric acid CAS Name: 2-ethoxy-5-ethyl-3,1-benzoxazin-4-one; sulfuric acid IUPAC Name: 2-ethoxy-5-ethyl-3,1-benzoxazin-4-one; sulfuric acid Traditional Name: 2-ethoxy-5-ethyl-3,1-benzoxazin-4-one; sulfuric acid Formula: C12H15NO7S MolecularWeight: 317.315

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)N=C(OC2=O)OCC.OS(=O)(=O)O

Isomeric SMILES

CCC1=C2C(=CC=C1)N=C(OC2=O)OCC.OS(=O)(=O)O

InChI

InChI=1S/C12H13NO3.H2O4S/c1-3-8-6-5-7-9-10(8)11(14)16-12(13-9)15-4-2;1-5(2,3)4/h5-7H,3-4H2,1-2H3;(H2,1,2,3,4)