769152-52-5
2-ETHOXY-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
Name2-ETHOXY-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
1Identification
【Name】
2-ETHOXY-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
【CAS】
【MDL】
MFCD05153532
【English Synonyms】
【Formula】
C31 H29 N3 O6
【MolWeight】
539.585
【Inchi】
InChI=1S/C31H29N3O6/c1-3-18-39-24-15-13-23(14-16-24)31(37)40-27-17-12-21(19-28(27)38-4-2)20-32-34-30(36)29(35)33-26-11-7-9-22-8-5-6-10-25(22)26/h5-17,19-20H,3-4,18H2,1-2H3,(H,33,35)(H,34,36)/b32-20+
【InChIKey】
InChIKey=OERXKWLPPWTSCS-UZWMFBFFSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2OCC)/C=N/NC(=O)C(=O)Nc3cccc4c3cccc4
【MOL File】
2-ETHOXY-4-(2-((1-NA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-ETHOXY-4-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE.cml