Basic information
- CAS
36911-68-9- Standard SMILES
CCOC(=O)c1ccc2[nH]c3c(c2c1)CN(C)CC3.Cl- InChIKey
DRVJIJWSFOAHTA-UHFFFAOYSA-N- Molecular formula
- C15H19ClN2O2
- Average molar mass
- 294.77 g/mol
- Monoisotopic mass
- 294.1135055
Names & identifiers
- Preferred name
- 5H-Pyrido(4,3-b)indole-8-carboxylic acid, 1,2,3,4-tetrahydro-2-methyl-, ethyl ester, hydrochloride
- IUPAC
- ethyl 2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate;hydrochloride
Names & synonyms
5H-Pyrido(4,3-b)indole-8-carboxylic acid, 1,2,3,4-tetrahydro-2-methyl-, ethyl ester, hydrochloride36911-68-9DTXSID601903908-(Ethoxycarbonyl)-2-methyl-1,2,3,4-tetrahydro-gamma-carboline hydrochloride1,2,3,4-Tetrahydro-2-methyl-5H-pyrido(4,3-b)indole-8-carboxylic acid ethyl ester HClRefChem:305774DTXCID70112881Ethyl 2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole-8-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
36911-68-9- PubChem CID
- 215969
- DTXSID
DTXSID60190390
Properties
Computed structural properties
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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