methyl (Z)-5-methyl-3-nitro-2-oxidanyl-2-(trifluoromethyl)hex-3-enoate

Systemtic Name: methyl (Z)-5-methyl-3-nitro-2-oxidanyl-2-(trifluoromethyl)hex-3-enoate Openeye Name: methyl (Z)-2-hydroxy-5-methyl-3-nitro-2-(trifluoromethyl)hex-3-enoate CAS Name: (Z)-2-hydroxy-5-methyl-3-nitro-2-(trifluoromethyl)-3-hexenoic acid methyl ester IUPAC Name: methyl (Z)-2-hydroxy-5-methyl-3-nitro-2-(trifluoromethyl)hex-3-enoate Traditional Name: (Z)-2-hydroxy-5-methyl-3-nitro-2-(trifluoromethyl)hex-3-enoic acid methyl ester Formula: C9H12F3NO5 MolecularWeight: 271.19049

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=C(C(C(=O)OC)(C(F)(F)F)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)/C=C(/C(C(=O)OC)(C(F)(F)F)O)\[N+](=O)[O-]

InChI

InChI=1S/C9H12F3NO5/c1-5(2)4-6(13(16)17)8(15,7(14)18-3)9(10,11)12/h4-5,15H,1-3H3/b6-4-