Basic information
- CAS
7511-22-0- Standard SMILES
C=CC1CN(C(C)=O)CCC1CCOC(=O)Nc1ccc([N+](=O)[O-])cc1- InChIKey
DONKPFVUOKHSFY-UHFFFAOYSA-N- Molecular formula
- C18H23N3O5
- Average molar mass
- 361.4 g/mol
- Monoisotopic mass
- 361.16377084
Names & identifiers
- Preferred name
- 2-(1-Acetyl-3-ethenylpiperidin-4-yl)ethyl (4-nitrophenyl)carbamate
- IUPAC
- 2-(1-acetyl-3-ethenylpiperidin-4-yl)ethyl N-(4-nitrophenyl)carbamate
Names & synonyms
7511-22-0NSC405984DTXSID403241912-(1-Acetyl-3-ethenylpiperidin-4-yl)ethyl (4-nitrophenyl)carbamateNSC-405984
Database identifiers
- CAS
7511-22-0- PubChem CID
- 347348
- DTXSID
DTXSID40324191
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 525
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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