Catalog Number:
AG001A0C
Chemical Name:
2-DIETHYLAMINOETHYL 2-PHENYLBUTYRATE CITRATE SALT
CAS Number:
13900-12-4
Molecular Formula:
C22H33NO9
Molecular Weight:
455.4987
MDL Number:
MFCD00035572
IUPAC Name:
2-(diethylamino)ethyl 2-phenylbutanoate;2-hydroxypropane-1,2,3-tricarboxylic acid
InChI:
InChI=1S/C16H25NO2.C6H8O7/c1-4-15(14-10-8-7-9-11-14)16(18)19-13-12-17(5-2)6-3;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-11,15H,4-6,12-13H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChI Key:
VVNURWKSPYZZCI-UHFFFAOYSA-N
SMILES:
OC(=O)CC(C(=O)O)(CC(=O)O)O.CCC(c1ccccc1)C(=O)OCCN(CC)CC
EC Number:
237-671-6
NSC Number:
11781
