| SpectraBase Spectrum ID |
10uuGBO2vuU |
| Name |
cis-(1R,3R)-Methyl 1-(4-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-B]indole-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.121906035 u |
| Formula |
C19H17N3O4 |
| InChI |
InChI=1S/C19H17N3O4/c1-26-19(23)16-10-14-13-4-2-3-5-15(13)20-18(14)17(21-16)11-6-8-12(9-7-11)22(24)25/h2-9,16-17,20-21H,10H2,1H3/t16-,17-/m1/s1 |
| InChIKey |
PMTFLAWFQMHLPS-IAGOWNOFSA-N |
| Molecular Weight |
351.362 g/mol |
| SMILES |
C12=C(C=3C=CC=CC3N2)C[C@](C(=O)OC)(N[C@@]1(C=1C=CC(N(=O)=O)=CC1)[H])[H] |
![cis-(1R,3R)-Methyl 1-(4-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate](/api/spectrum/10uuGBO2vuU/structure.png?h=300&w=458 "cis-(1R,3R)-Methyl 1-(4-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate")
