2-ethyl-3-methyl-1,3-benzoxazin-3-ium-4-one perchlorate

Systemtic Name: 2-ethyl-3-methyl-1,3-benzoxazin-3-ium-4-one perchlorate Openeye Name: 2-ethyl-3-methyl-1,3-benzoxazin-3-ium-4-one perchlorate CAS Name: 2-ethyl-3-methyl-1,3-benzoxazin-3-ium-4-one perchlorate IUPAC Name: 2-ethyl-3-methyl-1,3-benzoxazin-3-ium-4-one perchlorate Traditional Name: 2-ethyl-3-methyl-1,3-benzoxazin-3-ium-4-one perchlorate Formula: C11H12ClNO6 MolecularWeight: 289.66908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C(=O)C2=CC=CC=C2O1)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=[N+](C(=O)C2=CC=CC=C2O1)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H12NO2.ClHO4/c1-3-10-12(2)11(13)8-6-4-5-7-9(8)14-10;2-1(3,4)5/h4-7H,3H2,1-2H3;(H,2,3,4,5)/q+1;/p-1