554439-43-9
[2-(4-ETHOXY-BENZENESULFONYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL]-ACETIC ACID
Name
[2-(4-ETHOXY-BENZENESULFONYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL]-ACETIC ACID
Formula
C19 H21 N O5 S
MolWeight
375.443
1Identification
【Name】
[2-(4-ETHOXY-BENZENESULFONYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL]-ACETIC ACID
【CAS】
【MDL】
MFCD03988522
【English Synonyms】
【Formula】
C19 H21 N O5 S
【MolWeight】
375.443
【Inchi】
InChI=1S/C19H21NO5S/c1-2-25-15-7-9-16(10-8-15)26(23,24)20-12-11-14-5-3-4-6-17(14)18(20)13-19(21)22/h3-10,18H,2,11-13H2,1H3,(H,21,22)
【InChIKey】
InChIKey=LFOWPNYNQJVOGO-UHFFFAOYSA-N
【SMILES】
CCOc1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C2CC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[2-(4-ETHOXY-BENZENESULFONYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL]-ACETIC ACID.cml
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Catalog No:EN300-05690 50G
Catalog No:EN300-05690 1G
Catalog No:EN300-05690 10G
Catalog No:EN300-05690 2.5G
Catalog No:EN300-05690 5G
Catalog No:EN300-05690 25G
Catalog No:EN300-05690 250MG
Country/Region:Ukraine
Business Type:Trading Company
http://www.enamine.net
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