IUPAC name
2-(1-methylpropyl)-4,6-dinitrophenyl 3-methyl-2-butenoate
SMILES
CCC(C)c1cc(cc(c1OC(=O)C=C(C)C)N(=O)=O)N(=O)=O
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
binapacryl
IUPAC name
2-(1-methylpropyl)-4,6-dinitrophenyl 3-methyl-2-butenoate
SMILES
CCC(C)c1cc(cc(c1OC(=O)C=C(C)C)N(=O)=O)N(=O)=O
INCHI
InChI=1S/C15H18N2O6/c1-5-10(4)12-7-11(16(19)20)8-13(17(21)22)15(12)23-14(18)6-9(2)3/h6-8,10H,5H2,1-4H3
FORMULA
C15H18N2O6
Common name
binapacryl
IUPAC name
2-(1-methylpropyl)-4,6-dinitrophenyl 3-methyl-2-butenoate
Molecular weight
322.313
clogP
0.565
clogS
-3.573
HBond Acceptor
8
HBond Donor
0
Total Polar Surface Area
94.58
Number of Rings
1
Rotatable Bond
7
