Basic information
- CAS
5742-10-9- Standard SMILES
COc1ccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC- InChIKey
LMNPDJVAEFPPLV-UHFFFAOYSA-N- Molecular formula
- C17H18N2O5
- Average molar mass
- 330.33 g/mol
- Monoisotopic mass
- 330.12157168
Names & identifiers
- Preferred name
- 2-(3,4-dimethoxyphenyl)-N-(2-methyl-5-nitrophenyl)acetamide
- IUPAC
- 2-(3,4-dimethoxyphenyl)-N-(2-methyl-5-nitrophenyl)acetamide
Names & synonyms
2-(3,4-dimethoxyphenyl)-N-(2-methyl-5-nitrophenyl)acetamide5742-10-9CBMicro_029554Cambridge id 5742109Oprea1_159332DTXSID70972907STK093087AKOS003266748ST012092BIM-0029698.P001(3,4-Dimethoxyphenyl)-N-(2-methyl-5-nitrophenyl)ethanimidic acid2-(3,4-Dimethoxyphenyl)-N-(2-methyl-5-nitrophenyl)ethanimidic acid
Database identifiers
- CAS
5742-10-9- PubChem CID
- 720381
- DTXSID
DTXSID70972907
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…