Methyl 3-nitro-4-[[4-(trifluoromethyl)phenyl]iminomethyl]benzoate

HCID 57718470
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1ccc(C=Nc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1
InChIKey
HIIDHZXTDQBJBF-UHFFFAOYSA-N
Molecular formula
C16H11F3N2O4
Average molar mass
352.26 g/mol

Names & identifiers

Preferred name
Methyl 3-nitro-4-[[4-(trifluoromethyl)phenyl]iminomethyl]benzoate
IUPAC
methyl 3-nitro-4-[[4-(trifluoromethyl)phenyl]iminomethyl]benzoate

Names & synonyms

methyl 3-nitro-4-[[4-(trifluoromethyl)phenyl]iminomethyl]benzoateSCHEMBL3962027SCHEMBL3962030HIIDHZXTDQBJBF-AWQFTUOYSA-NHIIDHZXTDQBJBF-UHFFFAOYSA-N

Database identifiers

PubChem CID
57718470

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
84.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
4
Heavy atoms
25

Related reactions

1 records
New reaction record

Compound notes

Loading…