Catalog Number:
AG00DBB1
Chemical Name:
NSC305787 (hydrochloride)
CAS Number:
53868-26-1
Molecular Formula:
C25H31Cl3N2O
Molecular Weight:
481.8854
MDL Number:
MFCD29924224
IUPAC Name:
[2-(1-adamantyl)-6,8-dichloroquinolin-4-yl]-piperidin-2-ylmethanol;hydrochloride
InChI:
InChI=1S/C25H30Cl2N2O.ClH/c26-17-8-18-19(24(30)21-3-1-2-4-28-21)10-22(29-23(18)20(27)9-17)25-11-14-5-15(12-25)7-16(6-14)13-25;/h8-10,14-16,21,24,28,30H,1-7,11-13H2;1H
InChI Key:
JQALIVSYOXLOBE-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c2c(c1)c(cc(n2)C12CC3CC(C2)CC(C1)C3)C(C1CCCCN1)O.Cl
NSC Number:
305787
