769151-04-4
2-ETHOXY-4-(2-((4-METHYLPHENYL)SULFONYL)CARBOHYDRAZONOYL)PH 4-METHOXYBENZOATE
Name2-ETHOXY-4-(2-((4-METHYLPHENYL)SULFONYL)CARBOHYDRAZONOYL)PH 4-METHOXYBENZOATE
1Identification
【Name】
2-ETHOXY-4-(2-((4-METHYLPHENYL)SULFONYL)CARBOHYDRAZONOYL)PH 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05153857
【English Synonyms】
【Formula】
C24 H24 N2 O6 S
【MolWeight】
468.528
【Inchi】
InChI=1S/C24H24N2O6S/c1-4-31-23-15-18(16-25-26-33(28,29)21-12-5-17(2)6-13-21)7-14-22(23)32-24(27)19-8-10-20(30-3)11-9-19/h5-16,26H,4H2,1-3H3/b25-16+
【InChIKey】
InChIKey=XAWMTZPWJQDRDT-PCLIKHOPSA-N
【SMILES】
CCOc1cc(ccc1OC(=O)c2ccc(cc2)OC)/C=N/NS(=O)(=O)c3ccc(cc3)C
【MOL File】
2-ETHOXY-4-(2-((4-ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-ETHOXY-4-(2-((4-METHYLPHENYL)SULFONYL)CARBOHYDRAZONOYL)PH 4-METHOXYBENZOATE.cml