769156-69-6
4-BR-2-(2-((3-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE
Name4-BR-2-(2-((3-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE
1Identification
【Name】
4-BR-2-(2-((3-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE
【CAS】
【MDL】
MFCD05154309
【English Synonyms】
【Formula】
C24 H20 Br N3 O5
【MolWeight】
510.342
【Inchi】
InChI=1S/C24H20BrN3O5/c1-15-6-3-4-9-20(15)24(31)33-21-11-10-17(25)12-16(21)14-26-28-23(30)22(29)27-18-7-5-8-19(13-18)32-2/h3-14H,1-2H3,(H,27,29)(H,28,30)/b26-14+
【InChIKey】
InChIKey=RNNUYLOFZYPULY-VULFUBBASA-N
【SMILES】
Cc1ccccc1C(=O)Oc2ccc(cc2/C=N/NC(=O)C(=O)Nc3cccc(c3)OC)Br
【MOL File】
4-BR-2-(2-((3-METHOX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BR-2-(2-((3-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE.cml