769156-66-3
N-(2-(2-(2-BROMO-5-METHOXYBENZYLIDENE)HYDRAZINO)-2-OXOETHYL)-4-PROPOXYBENZAMIDE
NameN-(2-(2-(2-BROMO-5-METHOXYBENZYLIDENE)HYDRAZINO)-2-OXOETHYL)-4-PROPOXYBENZAMIDE
1Identification
【Name】
N-(2-(2-(2-BROMO-5-METHOXYBENZYLIDENE)HYDRAZINO)-2-OXOETHYL)-4-PROPOXYBENZAMIDE
【CAS】
【MDL】
MFCD05154311
【English Synonyms】
【Formula】
C20 H22 Br N3 O4
【MolWeight】
448.315
【Inchi】
InChI=1S/C20H22BrN3O4/c1-3-10-28-16-6-4-14(5-7-16)20(26)22-13-19(25)24-23-12-15-11-17(27-2)8-9-18(15)21/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,26)(H,24,25)/b23-12+
【InChIKey】
InChIKey=AQQGBFSIYDSDSJ-FSJBWODESA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)NCC(=O)N/N=C/c2cc(ccc2Br)OC
【MOL File】
N-(2-(2-(2-BROMO-5-M….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-(2-(2-BROMO-5-METHOXYBENZYLIDENE)HYDRAZINO)-2-OXOETHYL)-4-PROPOXYBENZAMIDE.cml