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Basic information
- Standard SMILES
COc1cccc(-n2cc(C)nc2-c2ccccc2C)c1[N+](=O)[O-]- InChIKey
WVACQDYEAOJONI-UHFFFAOYSA-N- Molecular formula
- C18H17N3O3
- Average molar mass
- 323.3 g/mol
Names & identifiers
- Preferred name
- 1-(3-Methoxy-2-nitro-phenyl)-4-methyl-2-o-tolyl-1H-imidazole
- IUPAC
- 1-(3-methoxy-2-nitrophenyl)-4-methyl-2-(2-methylphenyl)imidazole
Names & synonyms
SCHEMBL969679WVACQDYEAOJONI-UHFFFAOYSA-N1-(3-Methoxy-2-nitro-phenyl)-4-methyl-2-o-tolyl-1H-imidazole
Database identifiers
- PubChem CID
- 57732450
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 442
Related reactions
2 records
Compound notes
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