Carbamic acid, butyl-, diester with (2,3-dimethoxyphenethyl)iminodiethanol, maleate
Basic information
- CAS
26365-79-7- Standard SMILES
CCCCNC(=O)OCC[NH+](CCOC(=O)NCCCC)CCc1cccc(OC)c1OC.O=C([O-])/C=C\C(=O)O- InChIKey
XKRWNWBWAFVMJQ-BTJKTKAUSA-N- Molecular formula
- C28H45N3O10
- Average molar mass
- 583.7 g/mol
- Monoisotopic mass
- 583.31049464
Names & identifiers
- Preferred name
- Carbamic acid, butyl-, diester with (2,3-dimethoxyphenethyl)iminodiethanol, maleate
- IUPAC
- bis[2-(butylcarbamoyloxy)ethyl]-[2-(2,3-dimethoxyphenyl)ethyl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Names & synonyms
Carbamic acid, butyl-, diester with (2,3-dimethoxyphenethyl)iminodiethanol, maleate26365-79-7RefChem:1080878Ethanol, 2,2'-(2,3-dimethoxyphenethyl)iminodi-, bis(butylcarbamate), maleateCarbamic acid, butyl-, ((2-(2,3-dimethoxyphenyl)ethyl)imino)di-2,1-ethanediyl ester, (Z)-2-butenedioate (1:1)
Database identifiers
- CAS
26365-79-7- PubChem CID
- 6433985
Properties
Computed structural properties
- Topological polar surface area
- 177 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 20
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 624
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Compound notes
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