Catalog Number:
AG00071B
Chemical Name:
1,3-Propanediamine, N'-(7-chloro-6-nitro-4-quinolinyl)-N,N-diethyl-, phosphate (1:2) (9CI)
CAS Number:
102259-65-4
Molecular Formula:
C16H25ClN4O7P2
Molecular Weight:
482.7928
IUPAC Name:
N-(7-chloro-6-nitroquinolin-4-yl)-N',N'-diethylpropane-1,3-diamine;phosphoric acid
InChI:
InChI=1S/C16H21ClN4O2.2H3O4P/c1-3-20(4-2)9-5-7-18-14-6-8-19-15-11-13(17)16(21(22)23)10-12(14)15;2*1-5(2,3)4/h6,8,10-11H,3-5,7,9H2,1-2H3,(H,18,19);2*(H3,1,2,3,4)
InChI Key:
BOEXUUCLKBKHHY-UHFFFAOYSA-N
SMILES:
OP(=O)OP(=O)O.CCN(CCCNc1ccnc2c1cc([N+](=O)[O-])c(c2)Cl)CC