Basic information
- Standard SMILES
CC(=O)N1CCc2ccc(S(=O)(=O)N3CCOCC3)cc2C1- InChIKey
VMUVOUJZBCCXDH-UHFFFAOYSA-N- Molecular formula
- C15H20N2O4S
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- N-Acetyl-7-(morpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
- IUPAC
- 1-(7-morpholin-4-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
Names & synonyms
SCHEMBL4394801VMUVOUJZBCCXDH-UHFFFAOYSA-NN-Acetyl-7-(morpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Database identifiers
- PubChem CID
- 18176496
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 510
Related reactions
2 records
Compound notes
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