methyl (Z)-3-(propylamino)-2-[2,4,5-tris(fluoranyl)-3-methyl-6-nitro-phenyl]carbonyl-prop-2-enoate

Systemtic Name: methyl (Z)-3-(propylamino)-2-[2,4,5-tris(fluoranyl)-3-methyl-6-nitro-phenyl]carbonyl-prop-2-enoate Openeye Name: methyl (Z)-3-(propylamino)-2-(2,4,5-trifluoro-3-methyl-6-nitro-benzoyl)prop-2-enoate CAS Name: (Z)-2-[oxo-(2,4,5-trifluoro-3-methyl-6-nitrophenyl)methyl]-3-(propylamino)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(propylamino)-2-(2,4,5-trifluoro-3-methyl-6-nitrobenzoyl)prop-2-enoate Traditional Name: (Z)-3-(propylamino)-2-(2,4,5-trifluoro-3-methyl-6-nitro-benzoyl)acrylic acid methyl ester Formula: C15H15F3N2O5 MolecularWeight: 360.28521

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC=C(C(=O)C1=C(C(=C(C(=C1F)C)F)F)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCCN/C=C(/C(=O)C1=C(C(=C(C(=C1F)C)F)F)[N+](=O)[O-])\C(=O)OC

InChI

InChI=1S/C15H15F3N2O5/c1-4-5-19-6-8(15(22)25-3)14(21)9-10(16)7(2)11(17)12(18)13(9)20(23)24/h6,19H,4-5H2,1-3H3/b8-6-