ethyl 5,10-dimethyl-2-oxo-1-aza-5-azoniabicyclo[4.4.0]deca-3,5-diene-3-carboxylate; sulfonatooxymethane
Molecular Formula:
C
14
H
22
N
2
O
7
S
InChI:
InChI=1/C13H19N2O3.CH4O4S/c1-4-18-13(17)10-8-14(3)11-7-5-6-9(2)15(11)12(10)16;1-5-6(2,3)4/h8-9H,4-7H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1/fC13H19N2O3.CH3O4S/qm;-1
InChIKey:
InChIKey=SEISMQVOJUJKGE-BTUJPYTOCP
SMILES:
CCOC(=O)C1=C[N+](=C2CCCC(N2C1=O)C)C.COS(=O)(=O)[O-]
Names:
ethyl 5,10-dimethyl-2-oxo-1-aza-5-azoniabicyclo[4.4.0]deca-3,5-diene-3-carboxylate; sulfonatooxymethane
Registries:
PubChem CID 71939
PubChem ID 8194917
