| SpectraBase Spectrum ID |
7fPO6JHF8ZQ |
| Name |
2-Propenoic acid, 3-[4-[[(1,1-dimethylethoxy)carbonyl]methylamino]-1,3,4,5-tetrahydrobe nz[cd]indol-5-yl]-2-methyl-, methyl ester, [4.alpha.,5.beta.(Z)]-(.+-.)- |
| CAS Registry Number |
76084-16-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O4 |
| InChI |
InChI=1S/C22H28N2O4/c1-13(20(25)27-6)10-16-15-8-7-9-17-19(15)14(12-23-17)11-18(16)24(5)21(26)28-22(2,3)4/h7-10,12,16,18,23H,11H2,1-6H3/b13-10-/t16-,18+/m0/s1 |
| InChIKey |
OMEGRIQSUXXBPN-XOFUYBQVSA-N |
| Molecular Weight |
384.476 g/mol |
| SMILES |
[nH]1cc2c3c1cccc3[C@@]([C@@](C2)(N(C(OC(C)(C)C)=O)C)[H])(\C=C/(C(=O)OC)C)[H] |
| SPLASH |
splash10-0ue9-0390000000-9803d6cce7738219f103 |
| Source of Spectrum |
F-39-3704-0 |
| Synonyms |
Benz[cd]indole, 2-propenoic acid deriv.
Methyl (2Z)-3-{(4R,5S)-4-[(tert-butoxycarbonyl)(methyl)amino]-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl}-2-methyl-2-propenoate
Methyl (Z)-(4R*,5S*)-3-(4-(t-butoxycarbonyl)methylamino-1,3,4,5-tetrahydrobenz(cd)indol-5-yl)-2-methylpropenoate |
| Wiley ID |
1361671 |
![2-Propenoic acid, 3-[4-[[(1,1-dimethylethoxy)carbonyl]methylamino]-1,3,4,5-tetrahydrobe nz[cd]indol-5-yl]-2-methyl-, methyl ester, [4.alpha.,5.beta.(Z)]-(.+-.)-](/api/spectrum/7fPO6JHF8ZQ/structure.png?h=300&w=458 "2-Propenoic acid, 3-[4-[[(1,1-dimethylethoxy)carbonyl]methylamino]-1,3,4,5-tetrahydrobe nz[cd]indol-5-yl]-2-methyl-, methyl ester, [4.alpha.,5.beta.(Z)]-(.+-.)-")
