765286-85-9
5((4-CL-BENZOYL)OXY)2-(2-((1-NAPHTHOYLAMINO)AC)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE
Name5((4-CL-BENZOYL)OXY)2-(2-((1-NAPHTHOYLAMINO)AC)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE
1Identification
【Name】
5((4-CL-BENZOYL)OXY)2-(2-((1-NAPHTHOYLAMINO)AC)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE
【CAS】
【MDL】
MFCD06200088
【English Synonyms】
【Formula】
C34 H23 Cl2 N3 O6
【MolWeight】
640.477
【Inchi】
InChI=1S/C34H23Cl2N3O6/c35-25-13-8-22(9-14-25)33(42)44-27-17-12-24(30(18-27)45-34(43)23-10-15-26(36)16-11-23)19-38-39-31(40)20-37-32(41)29-7-3-5-21-4-1-2-6-28(21)29/h1-19H,20H2,(H,37,41)(H,39,40)/b38-19+
【InChIKey】
InChIKey=FNSOACKJGAMJSZ-OEPDXVHDSA-N
【SMILES】
c1ccc2c(c1)cccc2C(=O)NCC(=O)N/N=C/c3ccc(cc3OC(=O)c4ccc(cc4)Cl)OC(=O)c5ccc(cc5)Cl
【MOL File】
5((4-CL-BENZOYL)OXY)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5((4-CL-BENZOYL)OXY)2-(2-((1-NAPHTHOYLAMINO)AC)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE.cml