ethyl 4-[(N-tert-butyl-C-prop-1-en-2-ylcarbonimidoyl)amino]benzoate
Basic information
- CAS
75224-89-4- Standard SMILES
C=C(C)C(=NC(C)(C)C)Nc1ccc(C(=O)OCC)cc1- InChIKey
GBUGPEZTKAWKLE-UHFFFAOYSA-N- Molecular formula
- C17H24N2O2
- Average molar mass
- 288.4 g/mol
- Monoisotopic mass
- 288.18377801
Names & identifiers
- Preferred name
- ethyl 4-[(N-tert-butyl-C-prop-1-en-2-ylcarbonimidoyl)amino]benzoate
- IUPAC
- ethyl 4-[(N-tert-butyl-C-prop-1-en-2-ylcarbonimidoyl)amino]benzoate
Names & synonyms
75224-89-4NSC319873ethyl 4-[(N-tert-butyl-C-prop-1-en-2-ylcarbonimidoyl)amino]benzoateDTXSID40317705NSC-319873Ethyl 4-[(1E)-N-tert-butyl-2-methylprop-2-enimidamido]benzoateBenzoic acid,1-dimethylethyl)amino]-2-methyl-2-propenylidene]amino]-, ethyl ester
Database identifiers
- CAS
75224-89-4- PubChem CID
- 330669
- DTXSID
DTXSID40317705
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 400
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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