13672-23-6
(1-BENZYL-3-HYDROXY-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YL)-ACETIC ACID
Name(1-BENZYL-3-HYDROXY-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YL)-ACETIC ACID
1Identification
【Name】
(1-BENZYL-3-HYDROXY-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YL)-ACETIC ACID
【CAS】
【MDL】
MFCD03043405
【English Synonyms】
【Formula】
C17 H15 N O4
【MolWeight】
297.309
【Inchi】
InChI=1S/C17H15NO4/c19-15(20)10-17(22)13-8-4-5-9-14(13)18(16(17)21)11-12-6-2-1-3-7-12/h1-9,22H,10-11H2,(H,19,20)
【InChIKey】
InChIKey=LKEBDCHEEHJJIQ-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)CN2c3ccccc3C(C2=O)(CC(=O)O)O
【MOL File】
(1-BENZYL-3-HYDROXY-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(1-BENZYL-3-HYDROXY-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YL)-ACETIC ACID.cml