769147-66-2
3-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
Name3-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
1Identification
【Name】
3-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05154247
【English Synonyms】
【Formula】
C30 H26 N2 O5
【MolWeight】
494.544
【Inchi】
InChI=1S/C30H26N2O5/c1-21-6-8-22(9-7-21)20-36-27-16-10-24(11-17-27)29(33)32-31-19-23-4-3-5-28(18-23)37-30(34)25-12-14-26(35-2)15-13-25/h3-19H,20H2,1-2H3,(H,32,33)/b31-19+
【InChIKey】
InChIKey=KCCTWKZYGIJQLJ-ZCTHSVRISA-N
【SMILES】
Cc1ccc(cc1)COc2ccc(cc2)C(=O)N/N=C/c3cccc(c3)OC(=O)c4ccc(cc4)OC
【MOL File】
3-(2-(4-((4-METHYLBE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE.cml