prop-2-ynyl 2-[2-[3-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenyl]-2-oxidanylidene-ethoxy]-2-nitro-ethanoate

Systemtic Name: prop-2-ynyl 2-[2-[3-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenyl]-2-oxidanylidene-ethoxy]-2-nitro-ethanoate Openeye Name: prop-2-ynyl 2-[2-[3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]-2-oxo-ethoxy]-2-nitro-acetate CAS Name: 2-[2-[3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]-2-oxoethoxy]-2-nitroacetic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-[2-[3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]-2-oxoethoxy]-2-nitroacetate Traditional Name: 2-[2-[3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]-2-keto-ethoxy]-2-nitro-acetic acid propargyl ester Formula: C20H13ClF3NO7 MolecularWeight: 471.76793

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)C([N+](=O)[O-])OCC(=O)C1=CC(=CC=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

C#CCOC(=O)C([N+](=O)[O-])OCC(=O)C1=CC(=CC=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C20H13ClF3NO7/c1-2-8-30-19(27)18(25(28)29)31-11-16(26)12-4-3-5-14(9-12)32-17-7-6-13(10-15(17)21)20(22,23)24/h1,3-7,9-10,18H,8,11H2