180859-75-0
ETHYL ALPHA-CYANO-4-(4-MORPHOLINYLCARBONYL)-2-QUINOLINEACETATE
NameETHYL ALPHA-CYANO-4-(4-MORPHOLINYLCARBONYL)-2-QUINOLINEACETATE
1Identification
【Name】
ETHYL ALPHA-CYANO-4-(4-MORPHOLINYLCARBONYL)-2-QUINOLINEACETATE
【CAS】
【MDL】
MFCD01759707
【English Synonyms】
【Formula】
C19 H19 N3 O4
【MolWeight】
353.376
【Inchi】
InChI=1S/C19H19N3O4/c1-2-26-19(24)15(12-20)17-11-14(13-5-3-4-6-16(13)21-17)18(23)22-7-9-25-10-8-22/h3-6,11,15H,2,7-10H2,1H3
【InChIKey】
InChIKey=FSPCNIATCQGCQS-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(C#N)c1cc(c2ccccc2n1)C(=O)N3CCOCC3
【MOL File】
ETHYL ALPHA-CYANO-4-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL ALPHA-CYANO-4-(4-MORPHOLINYLCARBONYL)-2-QUINOLINEACETATE.cml