791722-16-2
2(1H)-ISOQUINOLINECARBOXIMIDAMIDE, 3-ETHYL-3,4-DIHYDRO-N-HYDROXY-
Name2(1H)-ISOQUINOLINECARBOXIMIDAMIDE, 3-ETHYL-3,4-DIHYDRO-N-HYDROXY-
1Identification
【Name】
2(1H)-ISOQUINOLINECARBOXIMIDAMIDE, 3-ETHYL-3,4-DIHYDRO-N-HYDROXY-
【CAS】
【MDL】
MFCD09751621
【English Synonyms】
【Formula】
C12 H17 N3 O
【MolWeight】
219.286
【Inchi】
InChI=1S/C12H17N3O/c1-2-11-7-9-5-3-4-6-10(9)8-15(11)12(13)14-16/h3-6,11,16H,2,7-8H2,1H3,(H2,13,14)
【InChIKey】
InChIKey=WLPFGAAYVYZNCH-UHFFFAOYSA-N
【SMILES】
CCC1Cc2ccccc2CN1/C(=N/O)/N
【MOL File】
2(1H)-ISOQUINOLINECA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2(1H)-ISOQUINOLINECARBOXIMIDAMIDE, 3-ETHYL-3,4-DIHYDRO-N-HYDROXY-.cml