Basic information
- Standard SMILES
Cc1nc(N(C)Cc2ccc(Cl)cc2)c2ccccc2c1CC(=O)O.Cl- InChIKey
QVEAHIRGVAONRO-UHFFFAOYSA-N- Molecular formula
- C20H20Cl2N2O2
- Average molar mass
- 391.3 g/mol
Names & identifiers
- Preferred name
- 1-(N-4-Chlorobenzyl-N-methyl-amino)-3-methyl-4-isoquinoline Acetic Acid Hydrochloride
- IUPAC
- 2-[1-[(4-chlorophenyl)methyl-methylamino]-3-methylisoquinolin-4-yl]acetic acid;hydrochloride
Names & synonyms
SCHEMBL11374233QVEAHIRGVAONRO-UHFFFAOYSA-N1-(N-4-Chlorobenzyl-N-methyl-amino)-3-methyl-4-isoquinoline Acetic Acid Hydrochloride
Database identifiers
- PubChem CID
- 70574151
Properties
Computed structural properties
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 453
Related reactions
1 records
Compound notes
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