767312-09-4
4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
Name4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
pro_formulaC32 H29 Cl N2 O5
1Identification
【Name】
4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
【CAS】
【MDL】
MFCD05720822
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C32 H29 Cl N2 O5
【pro_molWeight】
557.043
【Inchi】
InChI=1S/C32H29ClN2O5/c1-2-3-20-38-28-18-10-26(11-19-28)32(37)40-30-14-6-23(7-15-30)21-34-35-31(36)25-8-16-29(17-9-25)39-22-24-4-12-27(33)13-5-24/h4-19,21H,2-3,20,22H2,1H3,(H,35,36)/b34-21+
【InChIKey】
InChIKey=APJYAVWEQHIOON-KEIPNQJHSA-N
【SMILES】
CCCCOc1ccc(cc1)C(=O)Oc2ccc(cc2)/C=N/NC(=O)c3ccc(cc3)OCc4ccc(cc4)Cl
【MOL File】
4-(2-(4-((4-CHLOROBE….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:7.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE.cml