769147-60-6
2-MEO-4-(2-((4-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
Name2-MEO-4-(2-((4-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
1Identification
【Name】
2-MEO-4-(2-((4-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE
【CAS】
【MDL】
MFCD05154250
【English Synonyms】
【Formula】
C27 H27 N3 O7
【MolWeight】
505.524
【Inchi】
InChI=1S/C27H27N3O7/c1-4-15-36-22-10-6-19(7-11-22)27(33)37-23-14-5-18(16-24(23)35-3)17-28-30-26(32)25(31)29-20-8-12-21(34-2)13-9-20/h5-14,16-17H,4,15H2,1-3H3,(H,29,31)(H,30,32)/b28-17+
【InChIKey】
InChIKey=BJRJOYGWPZSJML-OGLMXYFKSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2OC)/C=N/NC(=O)C(=O)Nc3ccc(cc3)OC
【MOL File】
2-MEO-4-(2-((4-METHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:10
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-MEO-4-(2-((4-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-PROPOXYBENZOATE.cml