767305-62-4
4-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE
Name4-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE
1Identification
【Name】
4-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE
【CAS】
【MDL】
MFCD05720960
【English Synonyms】
【Formula】
C27 H22 N2 O3
【MolWeight】
422.482
【Inchi】
InChI=1S/C27H22N2O3/c1-19-6-4-10-23(16-19)27(31)32-24-14-12-20(13-15-24)18-28-29-26(30)17-22-9-5-8-21-7-2-3-11-25(21)22/h2-16,18H,17H2,1H3,(H,29,30)/b28-18+
【InChIKey】
InChIKey=RXYFOEGMQHQSIY-MTDXEUNCSA-N
【SMILES】
Cc1cccc(c1)C(=O)Oc2ccc(cc2)/C=N/NC(=O)Cc3cccc4c3cccc4
【MOL File】
4-(2-(1-NAPHTHYLACET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 3-METHYLBENZOATE.cml