769153-19-7
4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
Name4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
1Identification
【Name】
4-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
【CAS】
【MDL】
MFCD05153457
【English Synonyms】
【Formula】
C27 H25 N3 O5
【MolWeight】
471.51
【Inchi】
InChI=1S/C27H25N3O5/c1-3-19-9-13-22(14-10-19)29-26(32)27(33)30-28-18-21-11-15-23(24(17-21)34-2)35-25(31)16-12-20-7-5-4-6-8-20/h4-18H,3H2,1-2H3,(H,29,32)(H,30,33)/b16-12+,28-18+
【InChIKey】
InChIKey=MCDGXFNFCKJBPI-ZZTXFNBYSA-N
【SMILES】
CCc1ccc(cc1)NC(=O)C(=O)N/N=C/c2ccc(c(c2)OC)OC(=O)/C=C/c3ccccc3
【MOL File】
4-(2-((4-ETHYLANILIN….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-(2-((4-ETHYLANILINO)(OXO)AC)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE.cml