Basic information
- Standard SMILES
Cc1cccc(C(=O)NC(C)C)c1[N+](=O)[O-]- InChIKey
ZNZJTSGMNMHUOB-UHFFFAOYSA-N- Molecular formula
- C11H14N2O3
- Average molar mass
- 222.24 g/mol
Names & identifiers
- Preferred name
- 3-methyl-N-(1-methylethyl)-2-nitrobenzamide
- IUPAC
- 3-methyl-2-nitro-N-propan-2-ylbenzamide
Names & synonyms
N-ISOPROPYL-3-METHYL-2-NITROBENZAMIDE3-methyl-N-(1-methylethyl)-2-nitrobenzamideSCHEMBL3189723ZNZJTSGMNMHUOB-UHFFFAOYSA-NSTL261211AKOS0032986343-methyl-2-nitro-N-(propan-2-yl)benzamideST50635482SR-01000261923N-(methylethyl)(3-methyl-2-nitrophenyl)carboxamideSR-01000261923-1
Database identifiers
- PubChem CID
- 890272
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 273
Related reactions
24 records
Compound notes
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