N-(2,4-dimethoxyphenyl)-3-(4-nitrophenyl)prop-2-enamide
Basic information
- CAS
425425-43-0- Standard SMILES
COc1ccc(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)c(OC)c1- InChIKey
HUVKUMTWHOYHTP-UHFFFAOYSA-N- Molecular formula
- C17H16N2O5
- Average molar mass
- 328.32 g/mol
- Monoisotopic mass
- 328.10592162
Names & identifiers
- Preferred name
- N-(2,4-dimethoxyphenyl)-3-(4-nitrophenyl)prop-2-enamide
- IUPAC
- N-(2,4-dimethoxyphenyl)-3-(4-nitrophenyl)prop-2-enamide
Names & synonyms
N-(2,4-Dimethoxyphenyl)-3-(4-nitrophenyl)-2-propenamideN-(2,4-dimethoxyphenyl)-3-(4-nitrophenyl)prop-2-enamideDTXSID401204142425425-43-0
Database identifiers
- CAS
425425-43-0- PubChem CID
- 875490
- DTXSID
DTXSID401204142
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
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Compound notes
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