Basic information
- Standard SMILES
CC(=O)Oc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1- InChIKey
JODYLBSAUUOWOK-UHFFFAOYSA-N- Molecular formula
- C16H14N2O5
- Average molar mass
- 314.29 g/mol
- Monoisotopic mass
- 314.09027155
Names & identifiers
- Preferred name
- 4-acetoxy-N-(2-methyl-5-nitrophenyl)benzamide
- IUPAC
- [4-[(2-methyl-5-nitrophenyl)carbamoyl]phenyl] acetate
Names & synonyms
180136-44-14-[(2-methyl-5-nitrophenyl)carbamoyl]phenyl acetate4-((2-methyl-5-nitrophenyl)carbamoyl)phenyl acetate4-acetoxy-N-(2-methyl-5-nitrophenyl)benzamideOprea1_011356SCHEMBL6531798JODYLBSAUUOWOK-UHFFFAOYSA-NSTK093542AKOS001595718DB-324882ST50694833N-(2-methyl-5-nitrophenyl)-4-acetoxybenzamide
Show more names
4-[N-(2-methyl-5-nitrophenyl)carbamoyl]phenyl acetate
Database identifiers
- PubChem CID
- 776340
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 454
Related reactions
2 records
Compound notes
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