767339-08-2
3-(2-((2-METHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
Name3-(2-((2-METHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
1Identification
【Name】
3-(2-((2-METHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05153275
【English Synonyms】
【Formula】
C24 H22 N2 O5
【MolWeight】
418.447
【Inchi】
InChI=1S/C24H22N2O5/c1-17-6-3-4-9-22(17)30-16-23(27)26-25-15-18-7-5-8-21(14-18)31-24(28)19-10-12-20(29-2)13-11-19/h3-15H,16H2,1-2H3,(H,26,27)/b25-15+
【InChIKey】
InChIKey=UDGAKUTVNDDGLQ-MFKUBSTISA-N
【SMILES】
Cc1ccccc1OCC(=O)N/N=C/c2cccc(c2)OC(=O)c3ccc(cc3)OC
【MOL File】
3-(2-((2-METHYLPHENO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-((2-METHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE.cml