Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COC(=O)CC(=Cc1ccc(OC)cc1CN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC- InChIKey
UVGAAUBPDUCNTA-UHFFFAOYSA-N- Molecular formula
- C25H35NO9
- Average molar mass
- 493.5 g/mol
- Monoisotopic mass
- 493.23118169
Names & identifiers
- Preferred name
- Methyl (+)-3-carbomethoxy-4-[2-bis(tert-butoxycarbonyl)aminomethyl-4-methoxyphenyl]-3-butenoate
- IUPAC
- dimethyl 2-[[2-[[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-methoxyphenyl]methylidene]butanedioate
Names & synonyms
UVGAAUBPDUCNTA-UHFFFAOYSA-Nmethyl (+)-3-carbomethoxy-4-[2-bis(tert-butoxycarbonyl)aminomethyl-4-methoxyphenyl]-3-butenoatemethyl (+/-)-3-carbomethoxy-4-[2-bis(tert-butoxycarbonyl) aminomethyl-4-methoxyphenyl]-3-butenoateMethyl (+/-)-3-carbomethoxy-4-[2-bis(tert-butoxycarbonyl)aminomethyl-4-methoxyphenyl ]-3-butenoatemethyl (+/-)-3-carbomethoxy-4-[2-bis(tert-butoxycarbonyl)aminomethyl-4-methoxyphenyl]-3-butenoatemethyl (+/-)-3-carbomethoxy-4-[2-bis(tert-butoxycarbonyl)aminomethyl-4methoxyphenyl]-3-butenoatemethyl (+/-)-3-carbomethoxy-4[2-bis(tert-butoxycarbonyl)aminomethyl-4-methoxyphenyl]-3-butenoatemethyl (+/-)-3-carbomethoxy4-[2-bis(tert-butoxycarbonyl)aminomethyl-4-methoxyphenyl]-3-butenoate
Database identifiers
- PubChem CID
- 54374080
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 764
Related reactions
1 records
Compound notes
Loading…