ethyl 4-[[4-ethoxy-1,1,1-tris(fluoranyl)-4-oxidanylidene-butan-2-ylidene]amino]-3-iodanyl-benzoate

Systemtic Name: ethyl 4-[[4-ethoxy-1,1,1-tris(fluoranyl)-4-oxidanylidene-butan-2-ylidene]amino]-3-iodanyl-benzoate Openeye Name: ethyl 4-[[3-ethoxy-3-oxo-1-(trifluoromethyl)propylidene]amino]-3-iodo-benzoate CAS Name: 4-[(4-ethoxy-1,1,1-trifluoro-4-oxobutan-2-ylidene)amino]-3-iodobenzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxy-1,1,1-trifluoro-4-oxobutan-2-ylidene)amino]-3-iodobenzoate Traditional Name: 4-[[3-ethoxy-3-keto-1-(trifluoromethyl)propylidene]amino]-3-iodo-benzoic acid ethyl ester Formula: C15H15F3INO4 MolecularWeight: 457.18358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=NC1=C(C=C(C=C1)C(=O)OCC)I)C(F)(F)F

Isomeric SMILES

CCOC(=O)CC(=NC1=C(C=C(C=C1)C(=O)OCC)I)C(F)(F)F

InChI

InChI=1S/C15H15F3INO4/c1-3-23-13(21)8-12(15(16,17)18)20-11-6-5-9(7-10(11)19)14(22)24-4-2/h5-7H,3-4,8H2,1-2H3