IUPAC name
3-[[(1-methylethoxy)carbonyl]amino]phenyl N-ethyl-N-phenylcarbamate
SMILES
CCN(c1ccccc1)C(=O)Oc1cccc(c1)NC(=O)OC(C)C
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
phenisopham
IUPAC name
3-[[(1-methylethoxy)carbonyl]amino]phenyl N-ethyl-N-phenylcarbamate
SMILES
CCN(c1ccccc1)C(=O)Oc1cccc(c1)NC(=O)OC(C)C
INCHI
InChI=1S/C19H22N2O4/c1-4-21(16-10-6-5-7-11-16)19(23)25-17-12-8-9-15(13-17)20-18(22)24-14(2)3/h5-14H,4H2,1-3H3,(H,20,22)
FORMULA
C19H22N2O4
Common name
phenisopham
IUPAC name
3-[[(1-methylethoxy)carbonyl]amino]phenyl N-ethyl-N-phenylcarbamate
Molecular weight
342.389
clogP
2.716
clogS
-3.417
HBond Acceptor
5
HBond Donor
1
Total Polar Surface Area
71.36
Number of Rings
2
Rotatable Bond
8
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00042 | propan-2-ol |
|
CC(O)C | 0.0278 |
| FDBF01132 | ethylcarbamic acid |
|
O=C(O)NCC | 0.0034 |
| FDBF01315 | N-phenylformamide |
|
c1(ccccc1)NC=O | 0.0058 |
| FDBF05966 | phenylcarbamic acid |
|
c1(ccccc1)NC(=O)O | 0.0014 |
| FDBF06400 | ethyl(phenyl)carbamic acid |
|
c1(ccccc1)N(CC)C(=O)O | 0.0003 |
| FDBF06401 | propan-2-yl N-phenylcarbamate |
|
O(C(C)C)C(=O)Nc1ccccc1 | 0.0007 |
8 ,
1
