Basic information
- Standard SMILES
COC(=O)/C(=C/C1(C)CCCCC1)NC(=O)OCc1ccccc1- InChIKey
ITZZSUNGJZSHHO-SSZFMOIBSA-N- Molecular formula
- C19H25NO4
- Average molar mass
- 331.4 g/mol
Names & identifiers
- Preferred name
- Methyl (2Z)-2-{[(benzyloxy)carbonyl]amino}-3-(1-methylcyclohexyl)acrylate
- IUPAC
- methyl (Z)-3-(1-methylcyclohexyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate
Names & synonyms
SCHEMBL13723502ITZZSUNGJZSHHO-SSZFMOIBSA-NMethyl (2Z)-2-{[(benzyloxy)carbonyl]amino}-3-(1-methylcyclohexyl)acrylate
Database identifiers
- PubChem CID
- 59709685
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 460
Related reactions
1 records
Compound notes
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