765907-68-4
4-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE
Name4-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE
1Identification
【Name】
4-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE
【CAS】
【MDL】
MFCD06199899
【English Synonyms】
【Formula】
C25 H24 N2 O6
【MolWeight】
448.473
【Inchi】
InChI=1S/C25H24N2O6/c1-3-32-20-12-10-19(11-13-20)25(30)33-21-14-9-17(15-22(21)31-2)16-26-27-24(29)23(28)18-7-5-4-6-8-18/h4-16,23,28H,3H2,1-2H3,(H,27,29)/b26-16+
【InChIKey】
InChIKey=XWHAIXHLYVWRDS-WGOQTCKBSA-N
【SMILES】
CCOc1ccc(cc1)C(=O)Oc2ccc(cc2OC)/C=N/NC(=O)C(c3ccccc3)O
【MOL File】
4-(2-(HYDROXY(PHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE.cml