769153-18-6
2-ETHOXY-4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
Name2-ETHOXY-4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
1Identification
【Name】
2-ETHOXY-4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05153459
【English Synonyms】
【Formula】
C26 H24 Cl N3 O5
【MolWeight】
493.945
【Inchi】
InChI=1S/C26H24ClN3O5/c1-3-17-5-12-21(13-6-17)29-24(31)25(32)30-28-16-18-7-14-22(23(15-18)34-4-2)35-26(33)19-8-10-20(27)11-9-19/h5-16H,3-4H2,1-2H3,(H,29,31)(H,30,32)/b28-16+
【InChIKey】
InChIKey=RYZDCXHBDKCXDQ-LQKURTRISA-N
【SMILES】
CCc1ccc(cc1)NC(=O)C(=O)N/N=C/c2ccc(c(c2)OCC)OC(=O)c3ccc(cc3)Cl
【MOL File】
2-ETHOXY-4-(2-((4-ET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-ETHOXY-4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE.cml