Basic information
- Standard SMILES
CC1(C)C(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1(C)C- InChIKey
VKSISJUGSUMNAS-UHFFFAOYSA-N- Molecular formula
- C16H18N2O3
- Average molar mass
- 286.33 g/mol
Names & identifiers
- Preferred name
- (4-Nitro-1H-indol-3-yl)-(2,2,3,3-tetramethyl-cyclopropyl)-methanone
- IUPAC
- (4-nitro-1H-indol-3-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
Names & synonyms
SCHEMBL2077060VKSISJUGSUMNAS-UHFFFAOYSA-NAKOS015822009(4-Nitro-1H-indol-3-yl)-(2,2,3,3-tetramethyl-cyclopropyl)-methanone
Database identifiers
- PubChem CID
- 24823929
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 78.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 466
Related reactions
4 records
Compound notes
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