Basic information
- CAS
5928-87-0- Standard SMILES
O=C(CNc1cccc2ccccc12)c1ccc([N+](=O)[O-])cc1- InChIKey
KETOHIGKDROJRA-UHFFFAOYSA-N- Molecular formula
- C18H14N2O3
- Average molar mass
- 306.3 g/mol
- Monoisotopic mass
- 306.10044231
Names & identifiers
- Preferred name
- 2-(1-Naphthylamino)-1-(4-nitrophenyl)ethanone
- IUPAC
- 2-(naphthalen-1-ylamino)-1-(4-nitrophenyl)ethanone
Names & synonyms
2-(1-naphthylamino)-1-(4-nitrophenyl)ethanone5928-87-02-(naphthalen-1-ylamino)-1-(4-nitrophenyl)ethanoneCBMicro_008395Oprea1_245380MLS000571278CHEMBL1415104DTXSID60974713HMS2575F07SMSF0009875AKOS024362105CB10992
Show more names
SMR000193645BIM-0008522.P001ST509929211-{4-nitrophenyl}-2-(1-naphthylamino)ethanone2-(naphthylamino)-1-(4-nitrophenyl)ethan-1-oneAG-205/32459037SR-01000223637SR-01000223637-1
Database identifiers
- CAS
5928-87-0- PubChem CID
- 877451
- DTXSID
DTXSID60974713- ChEMBL
CHEMBL1415104
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 426
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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