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2-(5-nitropyridin-2-yl)sulfonylethyl 3-(trifluoromethyloxy)benzoate

2-(5-nitropyridin-2-yl)sulfonylethyl 3-(trifluoromethyloxy)benzoate

Systemtic Name:2-(5-nitropyridin-2-yl)sulfonylethyl 3-(trifluoromethyloxy)benzoate
Openeye Name:2-[(5-nitro-2-pyridyl)sulfonyl]ethyl 3-(trifluoromethoxy)benzoate
CAS Name:3-(trifluoromethoxy)benzoic acid 2-[(5-nitro-2-pyridinyl)sulfonyl]ethyl ester
IUPAC Name:2-(5-nitropyridin-2-yl)sulfonylethyl 3-(trifluoromethoxy)benzoate
Traditional Name:3-(trifluoromethoxy)benzoic acid 2-[(5-nitro-2-pyridyl)sulfonyl]ethyl ester
Formula: C15H11F3N2O7S
MolecularWeight: 420.31725
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)C(=O)OCCS(=O)(=O)C2=NC=C(C=C2)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)C(=O)OCCS(=O)(=O)C2=NC=C(C=C2)[N+](=O)[O-]


InChI

InChI=1S/C15H11F3N2O7S/c16-15(17,18)27-12-3-1-2-10(8-12)14(21)26-6-7-28(24,25)13-5-4-11(9-19-13)20(22)23/h1-5,8-9H,6-7H2


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