Catalog Number:
AG00ICAL
Chemical Name:
3-Acetoacetylamino-4-methoxytoluene-6-sulfonic acid ammonium salt
CAS Number:
72705-22-7
Molecular Formula:
C12H18N2O6S
Molecular Weight:
318.3461
MDL Number:
MFCD00044126
IUPAC Name:
azanium;5-methoxy-2-methyl-4-(3-oxobutanoylamino)benzenesulfonate
InChI:
InChI=1S/C12H15NO6S.H3N/c1-7-4-9(13-12(15)5-8(2)14)10(19-3)6-11(7)20(16,17)18;/h4,6H,5H2,1-3H3,(H,13,15)(H,16,17,18);1H3
InChI Key:
ZPDRZMNAFLBUOA-UHFFFAOYSA-N
SMILES:
COc1cc(c(cc1NC(=O)CC(=O)C)C)S(=O)(=O)[O-].[NH4+]
EC Number:
276-769-3
