Ammonium, diethyl(m-hydroxyphenyl)methyl-, methyl sulfate, methylcarbamate
Basic information
- CAS
63957-59-5- Standard SMILES
CC[N+](C)(CC)c1cccc(OC(=O)NC)c1.COS(=O)(=O)[O-]- InChIKey
VQTMWBHSVAYKSS-UHFFFAOYSA-N- Molecular formula
- C14H24N2O6S
- Average molar mass
- 348.42 g/mol
- Monoisotopic mass
- 348.13550766
Names & identifiers
- Preferred name
- Ammonium, diethyl(m-hydroxyphenyl)methyl-, methyl sulfate, methylcarbamate
- IUPAC
- diethyl-methyl-[3-(methylcarbamoyloxy)phenyl]azanium;methyl sulfate
Names & synonyms
TL-1317AMMONIUM, DIETHYL(m-HYDROXYPHENYL)METHYL-, METHYL SULFATE, METHYLCARBAMATE63957-59-5Carbamic acid, N-methyl-, 3-diethylaminophenyl ester, methosulfateAmmonium, (3-(N-carbamoyloxy)phenyl)diethylmethyl-, methosulfateDTXSID00213799Carbamic acid, N-methyl-, 3-diethylaminophenyl ester, dimethylsulfateAmmonium, (m-hydroxyphenyl)diethylmethyl-, methosulfate, methylcarbamateCarbamic acid, methyl-, m-(diethylmethylammonio)phenyl ester, methosulfateRefChem:319256DTXCID80136290N,N-Diethyl-N-methyl-3-[(methylcarbamoyl)oxy]anilinium methyl sulfate
Database identifiers
- CAS
63957-59-5- PubChem CID
- 45744
- DTXSID
DTXSID00213799
Properties
Computed structural properties
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 342
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…