Basic information
- CAS
136945-66-9- Standard SMILES
COC(=O)c1ccc(OC)cc1NC(=O)c1ccc(OC)cc1- InChIKey
MSZPXGZVFHVHSG-UHFFFAOYSA-N- Molecular formula
- C17H17NO5
- Average molar mass
- 315.32 g/mol
- Monoisotopic mass
- 315.11067264
Overview
Methoxydianthramide A methyl ester has been reported in Dianthus caryophyllus with data available.
Names & identifiers
- Preferred name
- Methoxydianthramide A methyl ester
- IUPAC
- methyl 4-methoxy-2-[(4-methoxybenzoyl)amino]benzoate
Names & synonyms
Methoxydianthramide A methyl ester136945-66-9Methyl 4-methoxy-2-[(4-methoxybenzoyl)amino]benzoateDTXSID00160012Benzoic acid, 4-methoxy-2-((4-methoxybenzoyl)amino)-, methyl estermethyl 4-methoxy-2-((4-methoxybenzoyl)amino)benzoateRefChem:157078DTXCID2082503METHYL 4-METHOXY-2-(4-METHOXYBENZAMIDO)BENZOATE
Database identifiers
- CAS
136945-66-9- PubChem CID
- 178369
- DTXSID
DTXSID00160012- Nikkaji
- J505.886D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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