Basic information
- Standard SMILES
Cl.O=C(Nc1ccc(N2CCCC2)nc1)Oc1ccc([N+](=O)[O-])cc1- InChIKey
GXWJRCFXSKNVPZ-UHFFFAOYSA-N- Molecular formula
- C16H17ClN4O4
- Average molar mass
- 364.78 g/mol
Names & identifiers
- Preferred name
- (6-Pyrrolidin-1-yl-pyridin-3-yl)-carbamic acid 4-nitrophenyl ester hydrochloride
- IUPAC
- (4-nitrophenyl) N-(6-pyrrolidin-1-yl-3-pyridinyl)carbamate;hydrochloride
Names & synonyms
SCHEMBL4967284GXWJRCFXSKNVPZ-UHFFFAOYSA-N(6-pyrrolidin-1-yl-pyridin-3-yl)-carbamic acid 4-nitrophenyl ester hydrochloride
Database identifiers
- PubChem CID
- 69260792
Properties
Computed structural properties
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 442
Related reactions
1 records
Compound notes
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