Basic information
- CAS
64051-20-3- Standard SMILES
CCNC(=O)Oc1cccc([N+](C)(C)C)c1.COS(=O)(=O)[O-]- InChIKey
MHCNMRCYCFSNID-UHFFFAOYSA-N- Molecular formula
- C13H22N2O6S
- Average molar mass
- 334.39 g/mol
- Monoisotopic mass
- 334.1198576
Names & identifiers
- Preferred name
- Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, ethylcarbamate
- IUPAC
- [3-(ethylcarbamoyloxy)phenyl]-trimethylazanium;methyl sulfate
Names & synonyms
AR-21AMMONIUM, (m-HYDROXYPHENYL)TRIMETHYL-, METHYLSULFATE, ETHYLCARBAMATE64051-20-3Ethylcarbamic ester of m-oxyphenyltrimethylammonium methylsulfateDTXSID70214192Ammonium, (3-(N-ethylcarbamoyloxy)phenyl)trimethyl-, methylsulfateCarbamic acid, N-ethyl-, 3-dimethylaminophenyl ester, methosulfateCarbamic acid, N-ethyl-, 3-(trimethylammonio)phenyl ester, methylsulfateRefChem:319018DTXCID70136683SCHEMBL294026283-[(ethylcarbamoyl)oxy]-N,N,N-trimethylanilinium methyl sulfate
Database identifiers
- CAS
64051-20-3- PubChem CID
- 47071
- DTXSID
DTXSID70214192
Properties
Computed structural properties
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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