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3-Anilino-2-(3,4,5-trimethoxybenzyl)acrylonitrile, (Mixture of cis/trans isomers)
For research use only. Not for therapeutic Use.
Catalog Number | R020549 |
CAS Number | 30078-48-9 |
Synonyms | Trimethoprim Impurity I |
Molecular Formula | C19H20N2O3 |
Purity | ≥95% |
Storage | -20°C |
IUPAC Name | (Z)-3-anilino-2-[(3,4,5-trimethoxyphenyl)methyl]prop-2-enenitrile |
InChI | InChI=1S/C19H20N2O3/c1-22-17-10-14(11-18(23-2)19(17)24-3)9-15(12-20)13-21-16-7-5-4-6-8-16/h4-8,10-11,13,21H,9H2,1-3H3/b15-13- |
InChIKey | LMGNGGBSQVPQCO-SQFISAMPSA-N |
SMILES | COC1=CC(=CC(=C1OC)OC)CC(=CNC2=CC=CC=C2)C#N |