Basic information
- Standard SMILES
CCOC(=O)CCC/C(=C\C(CC(=O)OCC)NC=O)CP(=O)(OC(C)C)OC(C)C- InChIKey
LAZQAMVZKFMPLW-LDADJPATSA-N- Molecular formula
- C21H38NO8P
- Average molar mass
- 463.5 g/mol
- Monoisotopic mass
- 463.23350417
Names & identifiers
- Preferred name
- diethyl E-2-formylamino-4-diisopropylphosphonomethyl-hept-3-ene-1,7-dicarboxylate
- IUPAC
- diethyl (E)-5-[di(propan-2-yloxy)phosphorylmethyl]-3-formamidonon-4-enedioate
Names & synonyms
SCHEMBL9659398LAZQAMVZKFMPLW-LDADJPATSA-Ndiethyl E-2-formylamino-4-diisopropylphosphonomethyl-hept-3-ene-1,7-dicarboxylate
Database identifiers
- PubChem CID
- 86746005
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 18
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 619
Related reactions
2 records
Compound notes
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