Catalog Number:
AG01AKJ7
Chemical Name:
3-(3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonyl)propanoic acid
CAS Number:
926204-58-2
Molecular Formula:
C12H14O6S
Molecular Weight:
286.3010
MDL Number:
MFCD09047648
IUPAC Name:
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)propanoic acid
InChI:
InChI=1S/C12H14O6S/c13-12(14)4-7-19(15,16)9-2-3-10-11(8-9)18-6-1-5-17-10/h2-3,8H,1,4-7H2,(H,13,14)
InChI Key:
ZUBRSJTYKYZRJW-UHFFFAOYSA-N
SMILES:
OC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2
