898781-32-3
ETHYL 7-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-7-OXOHEPTANOATE
NameETHYL 7-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-7-OXOHEPTANOATE
1Identification
【Name】
ETHYL 7-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-7-OXOHEPTANOATE
【CAS】
【MDL】
MFCD03842741
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C23 H33 N O5
【pro_molWeight】
403.516
【Inchi】
InChI=1S/C23H33NO5/c1-2-27-22(26)11-5-3-4-10-21(25)20-9-7-6-8-19(20)18-24-14-12-23(13-15-24)28-16-17-29-23/h6-9H,2-5,10-18H2,1H3
【InChIKey】
InChIKey=YNNJVIUFLWQGEC-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCCCCC(=O)c1ccccc1CN2CCC3(CC2)OCCO3
【MOL File】
ETHYL 7-[2-[8-(1,4-D….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:6
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
ETHYL 7-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-7-OXOHEPTANOATE.cml