3-ethoxy-4-[2-oxidanylidene-1-[4-(trifluoromethyl)phenyl]propyl]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-ethoxy-4-[2-oxidanylidene-1-[4-(trifluoromethyl)phenyl]propyl]cyclobut-3-ene-1,2-dione Openeye Name: 3-ethoxy-4-[2-oxo-1-[4-(trifluoromethyl)phenyl]propyl]cyclobut-3-ene-1,2-dione CAS Name: 3-ethoxy-4-[2-oxo-1-[4-(trifluoromethyl)phenyl]propyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-ethoxy-4-[2-oxo-1-[4-(trifluoromethyl)phenyl]propyl]cyclobut-3-ene-1,2-dione Traditional Name: 3-ethoxy-4-[2-keto-1-[4-(trifluoromethyl)phenyl]propyl]cyclobut-3-ene-1,2-quinone Formula: C16H13F3O4 MolecularWeight: 326.26723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C1=O)C(C2=CC=C(C=C2)C(F)(F)F)C(=O)C

Isomeric SMILES

CCOC1=C(C(=O)C1=O)C(C2=CC=C(C=C2)C(F)(F)F)C(=O)C

InChI

InChI=1S/C16H13F3O4/c1-3-23-15-12(13(21)14(15)22)11(8(2)20)9-4-6-10(7-5-9)16(17,18)19/h4-7,11H,3H2,1-2H3