765288-22-0
1-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
Name1-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
1Identification
【Name】
1-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD06200068
【English Synonyms】
【Formula】
C27 H22 N2 O5
【MolWeight】
454.48
【Inchi】
InChI=1S/C27H22N2O5/c1-33-21-14-11-20(12-15-21)27(32)34-24-16-13-18-7-5-6-10-22(18)23(24)17-28-29-26(31)25(30)19-8-3-2-4-9-19/h2-17,25,30H,1H3,(H,29,31)/b28-17+
【InChIKey】
InChIKey=OUSMHINDGBRQSB-OGLMXYFKSA-N
【SMILES】
COc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)C(c4ccccc4)O
【MOL File】
1-(2-(HYDROXY(PHENYL….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
1-(2-(HYDROXY(PHENYL)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE.cml