SpectraBase Spectrum ID |
9aUXyXqCnsh |
Name |
Methyl 2-[(2'--1'-cyano-1',2'-dihydroisoquinolin-1'-yl)methyl]-benzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H22N2O4 |
InChI |
InChI=1S/C27H22N2O4/c1-32-22-13-11-20(12-14-22)25(30)29-16-15-19-7-4-6-10-24(19)27(29,18-28)17-21-8-3-5-9-23(21)26(31)33-2/h3-16H,17H2,1-2H3 |
InChIKey |
IMSKHKIMKVGSDY-UHFFFAOYSA-N |
Molecular Weight |
438.483 g/mol |
SMILES |
C1(N(C(c2ccc(cc2)OC)=O)C=Cc2c1cccc2)(Cc1c(C(=O)OC)cccc1)C#N |
SPLASH |
splash10-000i-0940000000-eb393f8c282b66201b76 |
Source of Spectrum |
AH-134-1000-4 |
Synonyms |
Methyl 2-{[1-cyano-2-(4-methoxybenzoyl)-1,2-dihydro-1-isoquinolinyl]methyl}benzoate |
Wiley ID |
1546919 |