Basic information
- Standard SMILES
CC(=O)Nc1c(I)c(COC(C)=O)c(I)c(C(=O)NCC(COC(C)=O)OC(C)=O)c1I- InChIKey
HNFMHJNVMPDESZ-UHFFFAOYSA-N- Molecular formula
- C19H21I3N2O8
- Average molar mass
- 786.1 g/mol
Names & identifiers
- Preferred name
- N-acetyl-3-acetoxymethyl-5-(2,3-diacetoxypropylaminocarbonyl)-2,4,6-triiodoaniline
- IUPAC
- [3-acetamido-5-(2,3-diacetyloxypropylcarbamoyl)-2,4,6-triiodophenyl]methyl acetate
Names & synonyms
SCHEMBL7589719HNFMHJNVMPDESZ-UHFFFAOYSA-NN-acetyl-3-acetoxymethyl-5-(2,3-diacetoxypropylamino-carbonyl)-2,4,6-triiodoanilineN-acetyl-3-acetoxymethyl-5-(2,3-diacetoxypropylaminocarbonyl)-2,4,6-triiodoaniline
Database identifiers
- PubChem CID
- 18429152
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 723
Related reactions
7 records
Compound notes
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