765911-99-7
4-(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
Name4-(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
1Identification
【Name】
4-(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
【CAS】
【MDL】
MFCD06199795
【English Synonyms】
【Formula】
C29 H31 N3 O8
【MolWeight】
549.577
【Inchi】
InChI=1S/C29H31N3O8/c1-5-14-39-22-12-8-20(9-13-22)29(35)40-23-10-6-19(7-11-23)17-31-32-26(33)18-30-28(34)21-15-24(36-2)27(38-4)25(16-21)37-3/h6-13,15-17H,5,14,18H2,1-4H3,(H,30,34)(H,32,33)/b31-17+
【InChIKey】
InChIKey=ZGYUZZMSTODNIA-KBVAKVRCSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2)/C=N/NC(=O)CNC(=O)c3cc(c(c(c3)OC)OC)OC
【MOL File】
4-(2-(((3,4,5-TRIMET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:11
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE.cml