N-(4-methoxybenzyl)-4-methyl-3-nitrobenzamide
Basic information
- CAS
313981-38-3- Standard SMILES
COc1ccc(CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1- InChIKey
IZODJIWKIAVAMT-UHFFFAOYSA-N- Molecular formula
- C16H16N2O4
- Average molar mass
- 300.31 g/mol
- Monoisotopic mass
- 300.111007
Names & identifiers
- Preferred name
- N-(4-methoxybenzyl)-4-methyl-3-nitrobenzamide
- IUPAC
- N-[(4-methoxyphenyl)methyl]-4-methyl-3-nitrobenzamide
Names & synonyms
N-(4-methoxybenzyl)-4-methyl-3-nitrobenzamideN-[(4-methoxyphenyl)methyl]-4-methyl-3-nitrobenzamideCBMicro_018438Cambridge id 5347248Oprea1_171024CCG-6882STK017102AKOS003270070ST010819BIM-0018540.P001SR-01000406918SR-01000406918-1
Show more names
N-[(4-methoxyphenyl)methyl](4-methyl-3-nitrophenyl)carboxamide
Database identifiers
- CAS
313981-38-3- PubChem CID
- 710839
- EC Number
- 169-531-4
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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