Basic information
- Standard SMILES
CCCCCCCOc1ccc(C(=O)Oc2ccc(CN(CC(=O)OC(C)(C)C)C(=O)c3ccc(N)cc3)cc2)cc1- InChIKey
SMJGQJDIYLSFDS-UHFFFAOYSA-N- Molecular formula
- C34H42N2O6
- Average molar mass
- 574.7 g/mol
Names & identifiers
- Preferred name
- 4-((4-amino-N-(2-(tert-butoxy)-2-oxoethyl)benzamido)methyl)phenyl 4-(heptyloxy)benzoate
- IUPAC
- [4-[[(4-aminobenzoyl)-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]methyl]phenyl] 4-heptoxybenzoate
Names & synonyms
SCHEMBL14126060SMJGQJDIYLSFDS-UHFFFAOYSA-N4-((4-amino-N-(2-(tert-butoxy)-2-oxoethyl)benzamido)methyl)phenyl 4-(heptyloxy)benzoate
Database identifiers
- PubChem CID
- 89253125
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 17
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 818
Related reactions
4 records
Compound notes
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