Basic information
- CAS
20162-20-3- Standard SMILES
O=[N+]([O-])c1ccc(Sc2ccc(N=Cc3ccccc3O)cc2)cc1- InChIKey
HVACYCUUXHEKBF-UHFFFAOYSA-N- Molecular formula
- C19H14N2O3S
- Average molar mass
- 350.4 g/mol
- Monoisotopic mass
- 350.07251349
Names & identifiers
- Preferred name
- Phenol, 2-[[[4-[(4-nitrophenyl)thio]phenyl]imino]methyl]-
- IUPAC
- 2-[[4-(4-nitrophenyl)sulfanylphenyl]iminomethyl]phenol
Names & synonyms
Phenol, 2-[[[4-[(4-nitrophenyl)thio]phenyl]imino]methyl]-20162-20-32-[[4-(4-nitrophenyl)sulfanylphenyl]iminomethyl]phenolDTXSID10425543AKOS001586754EU-00343292-[({4-[(4-nitrophenyl)sulfanyl]phenyl}imino)methyl]phenol2-[(E)-({4-[(4-NITROPHENYL)SULFANYL]PHENYL}IMINO)METHYL]PHENOL6-({4-[(4-Nitrophenyl)sulfanyl]anilino}methylidene)cyclohexa-2,4-dien-1-one
Database identifiers
- CAS
20162-20-3- PubChem CID
- 3940435
- DTXSID
DTXSID10425543
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 452
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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