[[4-[(4-chlorophenyl)-cyanomethylidene]cyclohexa-2,5-dien-1-ylidene]amino] N-naphthalen-1-ylcarbamate
Basic information
- CAS
7596-24-9- Standard SMILES
N#CC(=C1C=CC(=NOC(=O)Nc2cccc3ccccc23)C=C1)c1ccc(Cl)cc1- InChIKey
ORSPUNORYHXBIK-UHFFFAOYSA-N- Molecular formula
- C25H16ClN3O2
- Average molar mass
- 425.9 g/mol
- Monoisotopic mass
- 425.0931045
Names & identifiers
- Preferred name
- [[4-[(4-chlorophenyl)-cyanomethylidene]cyclohexa-2,5-dien-1-ylidene]amino] N-naphthalen-1-ylcarbamate
- IUPAC
- [[4-[(4-chlorophenyl)-cyanomethylidene]cyclohexa-2,5-dien-1-ylidene]amino] N-naphthalen-1-ylcarbamate
Names & synonyms
7596-24-9NSC405910[[4-[(4-chlorophenyl)-cyanomethylidene]cyclohexa-2,5-dien-1-ylidene]amino] N-naphthalen-1-ylcarbamateDTXSID70324164NSC-405910(2Z)-(4-Chlorophenyl)[(4Z)-4-({[(naphthalen-1-yl)carbamoyl]oxy}imino)cyclohexa-2,5-dien-1-ylidene]acetonitrile
Database identifiers
- CAS
7596-24-9- PubChem CID
- 347305
- DTXSID
DTXSID70324164
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 824
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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