767320-56-9
4-BROMO-2-(2-(3-HYDROXY-2-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
Name4-BROMO-2-(2-(3-HYDROXY-2-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
pro_formulaC28 H23 Br N2 O5
1Identification
【Name】
4-BROMO-2-(2-(3-HYDROXY-2-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
【CAS】
【MDL】
MFCD05154443
【EnglishSynonyms】
【pro_formula】
C28 H23 Br N2 O5
【pro_molWeight】
547.403
【Inchi】
InChI=1S/C28H23BrN2O5/c1-2-13-35-23-10-7-18(8-11-23)28(34)36-26-12-9-22(29)14-21(26)17-30-31-27(33)24-15-19-5-3-4-6-20(19)16-25(24)32/h3-12,14-17,32H,2,13H2,1H3,(H,31,33)/b30-17+
【InChIKey】
InChIKey=BXVOSQRIGCZHCJ-OCSSWDANSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2/C=N/NC(=O)c3cc4ccccc4cc3O)Br
【MOL File】
4-BROMO-2-(2-(3-HYDR….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:7
XLogP3:7.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-BROMO-2-(2-(3-HYDROXY-2-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE.cml