Basic information
- Standard SMILES
COc1cccc(C2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CCO2)c1- InChIKey
VGFKSVNLXOQQEJ-UHFFFAOYSA-N- Molecular formula
- C17H18N2O6S
- Average molar mass
- 378.4 g/mol
Names & identifiers
- Preferred name
- 2-(3-Methoxyphenyl)-4-(4-nitrophenyl)sulfonyl-morpholine
- IUPAC
- 2-(3-methoxyphenyl)-4-(4-nitrophenyl)sulfonylmorpholine
Names & synonyms
SCHEMBL15156301VGFKSVNLXOQQEJ-UHFFFAOYSA-N2-(3-Methoxyphenyl)-4-(4-nitrophenyl)sulfonyl-morpholine
Database identifiers
- PubChem CID
- 89725936
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 579
Related reactions
2 records
Compound notes
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