| SpectraBase Spectrum ID |
7PLr0rflSqo |
| Name |
2-Amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
431.176440168 u |
| Formula |
C26H26ClN3O |
| InChI |
InChI=1S/C26H26ClN3O/c1-15-10-16(2)21(12-18(15)14-31-24-9-8-19(27)11-17(24)3)25-20-6-4-5-7-23(20)30-26(29)22(25)13-28/h8-12H,4-7,14H2,1-3H3,(H2,29,30) |
| InChIKey |
UGSHPRYSNZEWFT-UHFFFAOYSA-N |
| Molecular Weight |
431.967 g/mol |
| SMILES |
NC=1C(=C(C=2C=C(COC=3C(=CC(=CC3)Cl)C)C(=CC2C)C)C2=C(N1)CCCC2)C#N |
![2-Amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile](/api/spectrum/7PLr0rflSqo/structure.png?h=300&w=458 "2-Amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile")
