769152-92-3
4-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE
Name4-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE
1Identification
【Name】
4-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE
【CAS】
【MDL】
MFCD05153486
【English Synonyms】
【Formula】
C25 H23 N3 O4
【MolWeight】
429.474
【Inchi】
InChI=1S/C25H23N3O4/c1-3-18-7-11-21(12-8-18)27-23(29)24(30)28-26-16-19-9-13-22(14-10-19)32-25(31)20-6-4-5-17(2)15-20/h4-16H,3H2,1-2H3,(H,27,29)(H,28,30)/b26-16+
【InChIKey】
InChIKey=JCEPRWSWPVDIOU-WGOQTCKBSA-N
【SMILES】
CCc1ccc(cc1)NC(=O)C(=O)N/N=C/c2ccc(cc2)OC(=O)c3cccc(c3)C
【MOL File】
4-(2-((4-ETHYLANILIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE.cml