| SpectraBase Spectrum ID |
B6rrmsfntRA |
| Name |
O-Phenyl N-{2-[2'-chloro-(4",5"-methylenedioxy-3"-oxo-1",3"-dihydroisobenzofuran-1"-yl)methyl]-4',5'-methylenedioxyphenyl}ethyl-N-methylthiocarbamate |
| Alternate Name(s) |
O-phenyl 2-{6-[chloro(8-oxo-6,8-dihydrofuro[3,4-e][1,3]benzodioxol-6-yl)methyl]-1,3-benzodioxol-5-yl}ethyl(methyl)thiocarbamate
O-Phenyl N-{2-[2'-chloro-(4'',5''-methylenedioxy-3''-oxo-1'',3''-dihydroisobenzofuran-1''-yl)methyl]-4',5'-methylenedioxyphenyl}ethyl-N-methylthiocarbamate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H22ClNO7S |
| InChI |
InChI=1S/C27H22ClNO7S/c1-29(27(37)35-16-5-3-2-4-6-16)10-9-15-11-20-21(33-13-32-20)12-18(15)23(28)24-17-7-8-19-25(34-14-31-19)22(17)26(30)36-24/h2-8,11-12,23-24H,9-10,13-14H2,1H3 |
| InChIKey |
JDXRIRJWUQAVAM-UHFFFAOYSA-N |
| Molecular Weight |
539.986 g/mol |
| SMILES |
c12C(OC(c2ccc2c1OCO2)C(c1c(cc2c(c1)OCO2)CCN(C(Oc1ccccc1)=S)C)Cl)=O |
| SPLASH |
splash10-02fx-9700000000-f5fedeb894da26c2ee30 |
| Source of Spectrum |
B-52-848-17 |
| Wiley ID |
746742 |
![O-Phenyl N-{2-[2'-chloro-(4",5"-methylenedioxy-3"-oxo-1",3"-dihydroisobenzofuran-1"-yl)methyl]-4',5'-methylenedioxyphenyl}ethyl-N-methylthiocarbamate](/api/spectrum/B6rrmsfntRA/structure.png?h=300&w=458 "O-Phenyl N-{2-[2'-chloro-(4\",5\"-methylenedioxy-3\"-oxo-1\",3\"-dihydroisobenzofuran-1\"-yl)methyl]-4',5'-methylenedioxyphenyl}ethyl-N-methylthiocarbamate")
