Basic information
- Standard SMILES
O=C(O)c1cccc(-c2ccn3ccccc23)c1[N+](=O)[O-].c1ccc(-c2ccccc2)cc1- InChIKey
YWENOJWXSYTVSX-UHFFFAOYSA-N- Molecular formula
- C27H20N2O4
- Average molar mass
- 436.5 g/mol
Names & identifiers
- Preferred name
- Biphenyl indolizinyl nitrobenzoate
- IUPAC
- 1,1'-biphenyl;3-indolizin-1-yl-2-nitrobenzoic acid
Names & synonyms
biphenyl indolizinyl nitrobenzoateYWENOJWXSYTVSX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86748744
Properties
Computed structural properties
- Topological polar surface area
- 87.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 522
Related reactions
2 records
Compound notes
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