SpectraBase Spectrum ID |
2Fd172HDkbk |
Name |
anti/syn-Ethyl 5-(phenylsulfonyl)-4,7-dihydro-4,7-ethano-2H-isoindole-1-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H19NO4S |
InChI |
InChI=1S/C19H19NO4S/c1-2-24-19(21)18-17-12-8-9-14(15(17)11-20-18)16(10-12)25(22,23)13-6-4-3-5-7-13/h3-7,10-12,14,20H,2,8-9H2,1H3/t12-,14-/m1/s1 |
InChIKey |
JAUBAGXVLAKBBW-TZMCWYRMSA-N |
Molecular Weight |
357.424 g/mol |
SMILES |
[nH]1c(c2[C@]3(C=C([C@@](c2c1)(CC3)[H])S(=O)(=O)c1ccccc1)[H])C(=O)OCC |
SPLASH |
splash10-004i-0029000000-0eb99b011ce16916e7c4 |
Source of Spectrum |
KC-0-4353-9 |
Synonyms |
8-Benzenesulfonyl-4-aza-tricyclo[5.2.2.0*2,6*]undeca-2,5,8-triene-3-carboxylic acid ethyl ester
Ethyl 8-(phenylsulfonyl)-4-azatricyclo[5.2.2.0(2,6)]undeca-2,5,8-triene-3-carboxylate |
Wiley ID |
832126 |