767288-41-5
2-MEO-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-ETHOXYBENZOATE
Name2-MEO-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-ETHOXYBENZOATE
1Identification
【Name】
2-MEO-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-ETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154514
【English Synonyms】
【Formula】
C29 H25 N3 O6
【MolWeight】
511.531
【Inchi】
InChI=1S/C29H25N3O6/c1-3-37-22-14-12-21(13-15-22)29(35)38-25-16-11-19(17-26(25)36-2)18-30-32-28(34)27(33)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-18H,3H2,1-2H3,(H,31,33)(H,32,34)/b30-18+
【InChIKey】
InChIKey=JARYZVHUWMJMIR-UXHLAJHPSA-N
【SMILES】
CCOc1ccc(cc1)C(=O)Oc2ccc(cc2OC)/C=N/NC(=O)C(=O)Nc3cccc4c3cccc4
【MOL File】
2-MEO-4-(2-((1-NAPHT….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-MEO-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-ETHOXYBENZOATE.cml