Compound Summary
Chlorantraniliprole
Compound Information
Chlorantraniliprole
Compound Name: | Chlorantraniliprole |
Compound CID: | 11271640 |
Synonyms: | Chlorantraniliprole |
Iupac Name: | 5-bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-2-(3-chloropyridin-2-yl)pyrazole-3-carboxamide |
InChI: | InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28) |
InChIKey: | PSOVNZZNOMJUBI-UHFFFAOYSA-N |
Canonical Smiles: | CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)Cl |
Isomeric Smiles: | CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)Cl |
Molecular Weight: | 483.1 |
Molecular Formula: | C18H14BrCl2N5O2 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Chlorantraniliprole
Molecular Weight: | 483.1 |
Molecular Formula: | C18H14BrCl2N5O2 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 28 |
Complexity: | 586 |
Synonyms
Chlorantraniliprole
Experimental Data
Chlorantraniliprole
Experimental Data Visualization
Chlorantraniliprole
Statistics Data
Chlorantraniliprole
Statistics Data Visualization
Chlorantraniliprole
