Catalog Number:
AG01EISX
Chemical Name:
2,6-Diaza-spiro[3.4]octan-7-one toluene-4-sulfonic acid salt
CAS Number:
1958100-97-4
Molecular Formula:
C13H18N2O4S
Molecular Weight:
298.3580
MDL Number:
MFCD29042820
IUPAC Name:
2,6-diazaspiro[3.4]octan-7-one;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C7H8O3S.C6H10N2O/c1-6-2-4-7(5-3-6)11(8,9)10;9-5-1-6(4-8-5)2-7-3-6/h2-5H,1H3,(H,8,9,10);7H,1-4H2,(H,8,9)
InChI Key:
UPALRTYMDUQVSC-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)O.O=C1NCC2(C1)CNC2
