769153-89-1
1-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE
Name1-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE
1Identification
【Name】
1-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE
【CAS】
【MDL】
MFCD05153370
【English Synonyms】
【Formula】
C29 H25 N3 O4
【MolWeight】
479.534
【Inchi】
InChI=1S/C29H25N3O4/c1-3-20-11-14-23(15-12-20)31-27(33)28(34)32-30-18-25-24-10-5-4-8-21(24)13-16-26(25)36-29(35)22-9-6-7-19(2)17-22/h4-18H,3H2,1-2H3,(H,31,33)(H,32,34)/b30-18+
【InChIKey】
InChIKey=RIYHKLWAPXCVPS-UXHLAJHPSA-N
【SMILES】
CCc1ccc(cc1)NC(=O)C(=O)N/N=C/c2c3ccccc3ccc2OC(=O)c4cccc(c4)C
【MOL File】
1-(2-((4-ETHYLANILIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((4-ETHYLANILINO)(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE.cml