Naptalam mixt. with dinoseb

Substructure search Find similar structures

Basic information

CAS: 8075-57-8
Standard SMILES: CCC(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O.O=C(O)c1ccccc1C(=O)Nc1cccc2ccccc12
InChIKey: NYUFRUQFEVCILT-UHFFFAOYSA-N
Molecular formula: C28H25N3O8
Average molar mass: 531.5 g/mol
Monoisotopic mass: 531.16416476

Names & identifiers

Preferred name: Naptalam mixt. with dinoseb
IUPAC: 2-butan-2-yl-4,6-dinitrophenol;2-(naphthalen-1-ylcarbamoyl)benzoic acid

Names & synonyms

Naptalam mixt. with dinoseb8075-57-82-((1-Naphthalenylamino)carbonyl)benzoic acid mixt. with 2-(1-methylpropyl)-4,6-dinitrophenolSCHEMBL5933908Benzoic acid, 2-((1-naphthalenylamino)carbonyl)-, mixt. with 2-(1-methylpropyl)-4,6-dinitrophenol

Database identifiers

CAS: 8075-57-8
PubChem CID: 165709

Properties

Computed structural properties

Topological polar surface area: 178 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 8
Rotatable bonds: 5
Heavy atoms: 39
Formal charge: 0
Complexity: 721

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…