IUPAC name
4-(1,1-dimethylethyl)-N-(1-methylpropyl)-2,6-dinitrobenzenamine
SMILES
CCC(C)Nc1c(cc(cc1N(=O)=O)C(C)(C)C)N(=O)=O
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
butralin
IUPAC name
4-(1,1-dimethylethyl)-N-(1-methylpropyl)-2,6-dinitrobenzenamine
SMILES
CCC(C)Nc1c(cc(cc1N(=O)=O)C(C)(C)C)N(=O)=O
INCHI
InChI=1S/C14H21N3O4/c1-6-9(2)15-13-11(16(18)19)7-10(14(3,4)5)8-12(13)17(20)21/h7-9,15H,6H2,1-5H3
FORMULA
C14H21N3O4
Common name
butralin
IUPAC name
4-(1,1-dimethylethyl)-N-(1-methylpropyl)-2,6-dinitrobenzenamine
Molecular weight
295.334
clogP
0.274
clogS
-4.294
HBond Acceptor
6
HBond Donor
1
Total Polar Surface Area
80.31
Number of Rings
1
Rotatable Bond
6
