ethyl hydrogen sulfate; 1-ethylquinoxalin-1-ium

Systemtic Name: ethyl hydrogen sulfate; 1-ethylquinoxalin-1-ium Openeye Name: ethyl hydrogen sulfate; 1-ethylquinoxalin-1-ium CAS Name: 1-ethylquinoxalin-1-ium; sulfuric acid ethyl ester IUPAC Name: ethyl hydrogen sulfate; 1-ethylquinoxalin-1-ium Traditional Name: 1-ethylquinoxalin-1-ium; sulfuric acid ethyl ester Formula: C12H17N2O4S+ MolecularWeight: 285.33938

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=NC2=CC=CC=C21.CCOS(=O)(=O)O

Isomeric SMILES

CC[N+]1=CC=NC2=CC=CC=C21.CCOS(=O)(=O)O

InChI

InChI=1S/C10H11N2.C2H6O4S/c1-2-12-8-7-11-9-5-3-4-6-10(9)12;1-2-6-7(3,4)5/h3-8H,2H2,1H3;2H2,1H3,(H,3,4,5)/q+1;