726153-69-1
2-(2-CARBOXY-ETHYL)-4-ETHYL-3-OXO-3,4-DIHYDRO-QUINOXALINE-6-CARBOXYLIC ACID ETHYL ESTER
Name2-(2-CARBOXY-ETHYL)-4-ETHYL-3-OXO-3,4-DIHYDRO-QUINOXALINE-6-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
2-(2-CARBOXY-ETHYL)-4-ETHYL-3-OXO-3,4-DIHYDRO-QUINOXALINE-6-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD03964611
【English Synonyms】
【Formula】
C16 H18 N2 O5
【MolWeight】
318.327
【Inchi】
InChI=1S/C16H18N2O5/c1-3-18-13-9-10(16(22)23-4-2)5-6-11(13)17-12(15(18)21)7-8-14(19)20/h5-6,9H,3-4,7-8H2,1-2H3,(H,19,20)
【InChIKey】
InChIKey=RMSGKZWAJGWCSV-UHFFFAOYSA-N
【SMILES】
CCn1c2cc(ccc2nc(c1=O)CCC(=O)O)C(=O)OCC
【MOL File】
2-(2-CARBOXY-ETHYL)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(2-CARBOXY-ETHYL)-4-ETHYL-3-OXO-3,4-DIHYDRO-QUINOXALINE-6-CARBOXYLIC ACID ETHYL ESTER.cml