← Back

Nom: 2-(6-nitrooxy-hexanoyloxy)-benzoic acid (2,2,5-trimethyl-[1,3]dioxan-5-yl carbamoyl)-methyl ester

IUPAC: [2-oxo-2-[(2,2,5-trimethyl-1,3-dioxan-5-yl)amino]ethyl] 2-(6-nitrooxyhexanoyloxy)benzoate

SMILES: CC1(NC(=O)COC(=O)c2ccccc2OC(=O)CCCCCO[N+](=O)[O-])COC(C)(C)OC1

Canonical SMILES: CC1(OCC(CO1)(C)NC(=O)COC(=O)C2=CC=CC=C2OC(=O)CCCCCO[N+](=O)[O-])C

Formule moléculaire: C22H30N2O10

Masse molaire: 482.50

InChIKey: NBGGUSDAPWQIJX-UHFFFAOYSA-N

InChI: InChI=1S/C22H30N2O10/c1-21(2)31-14-22(3,15-32-21)23-18(25)13-30-20(27)16-9-6-7-10-17(16)34-19(26)11-5-4-8-12-33-24(28)29/h6-7,9-10H,4-5,8,11-15H2,1-3H3,(H,23,25)

PubChem CID: 59445502 →

Synonymes

SCHEMBL554908NBGGUSDAPWQIJX-UHFFFAOYSA-N2-(6-nitrooxy-hexanoyloxy)-benzoic acid (2,2,5-trimethyl-[1,3]dioxan-5-yl carbamoyl)-methyl ester

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→