866008-14-2
ETHYL 1-BENZYL-5-HYDROXY-6-OXO-1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLATE
NameETHYL 1-BENZYL-5-HYDROXY-6-OXO-1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLATE
1Identification
【Name】
ETHYL 1-BENZYL-5-HYDROXY-6-OXO-1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLATE
【CAS】
【MDL】
MFCD05670100
【English Synonyms】
【Formula】
C15 H17 N O4
【MolWeight】
275.302
【Inchi】
InChI=1S/C15H17NO4/c1-2-20-15(19)12-8-9-16(14(18)13(12)17)10-11-6-4-3-5-7-11/h3-7,17H,2,8-10H2,1H3
【InChIKey】
InChIKey=NNCMYAKNFMNESG-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=C(C(=O)N(CC1)Cc2ccccc2)O
【MOL File】
ETHYL 1-BENZYL-5-HYD….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 1-BENZYL-5-HYDROXY-6-OXO-1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLATE.cml