| SpectraBase Spectrum ID |
aBWwyRGT97 |
| Name |
2-Benzyl-3-cyanomethyl-1-(3-cyanopent-2-en-1-yl)-3,4-dihydro-9-methyl-1H-pyrido[3,4-b]indole |
| Alternate Name(s) |
(1S,3S)-2-Benzyl-3-cyanomethyl-1-(3-cyanopent-2-en-1-yl)-3,4-dihydro-9-methyl-1H-pyrido[3,4-b]indole
(2Z)-4-[2-benzyl-3-(cyanomethyl)-9-methyl-2,3,4,9-tetrahydro-1H-.beta.-carbolin-1-yl]-2-ethyl-2-butenenitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H28N4 |
| InChI |
InChI=1S/C27H28N4/c1-3-20(18-29)13-14-26-27-24(23-11-7-8-12-25(23)30(27)2)17-22(15-16-28)31(26)19-21-9-5-4-6-10-21/h4-13,22,26H,3,14-15,17,19H2,1-2H3/b20-13-/t22-,26+/m1/s1 |
| InChIKey |
OOYXCOIQBGKYKV-OCUKBLQXSA-N |
| Molecular Weight |
408.549 g/mol |
| SMILES |
c12[n](c3ccccc3c2C[C@](N([C@]1(C\C=C/(C#N)CC)[H])Cc1ccccc1)(CC#N)[H])C |
| SPLASH |
splash10-03do-8319000000-b382542833680b1f045c |
| Source of Spectrum |
KC-0-3582-17 |
| Wiley ID |
831958 |
![2-Benzyl-3-cyanomethyl-1-(3-cyanopent-2-en-1-yl)-3,4-dihydro-9-methyl-1H-pyrido[3,4-b]indole](/api/spectrum/aBWwyRGT97/structure.png?h=300&w=458 "2-Benzyl-3-cyanomethyl-1-(3-cyanopent-2-en-1-yl)-3,4-dihydro-9-methyl-1H-pyrido[3,4-b]indole")
