1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-6-methyl-, methyl ester, hydrochloride
Basic information
- CAS
77941-21-0- Standard SMILES
COC(=O)c1c(OC)c2ccc(C)cc2n1CCN(C)C.Cl- InChIKey
DNIUYNVPCQIROC-UHFFFAOYSA-N- Molecular formula
- C16H23ClN2O3
- Average molar mass
- 326.82 g/mol
- Monoisotopic mass
- 326.1397203
Names & identifiers
- Preferred name
- 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-6-methyl-, methyl ester, hydrochloride
- IUPAC
- methyl 1-[2-(dimethylamino)ethyl]-3-methoxy-6-methylindole-2-carboxylate;hydrochloride
Names & synonyms
1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-6-methyl-, methyl ester, hydrochloride1-(beta-Dimethylaminoaethyl)-2-methoxycarbonyl-3-methoxy-6-methyl-indol-hydrochlorid [German]77941-21-0DTXSID902285991-(beta-Dimethylaminoaethyl)-2-methoxycarbonyl-3-methoxy-6-methyl-indol-hydrochloridRefChem:238949DTXCID90151090Methyl 1-[2-(dimethylamino)ethyl]-3-methoxy-6-methyl-1H-indole-2-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
77941-21-0- PubChem CID
- 3060293
- DTXSID
DTXSID90228599
Properties
Computed structural properties
- Topological polar surface area
- 43.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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