4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H10F3N3O3 MolecularWeight: 361.27481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C3C=C(C=CC3=O)[N+](=O)[O-])C=C(N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C3C=C(C=CC3=O)[N+](=O)[O-])C=C(N2)C(F)(F)F

InChI

InChI=1S/C17H10F3N3O3/c18-17(19,20)15-9-13(12-8-11(23(25)26)6-7-14(12)24)21-16(22-15)10-4-2-1-3-5-10/h1-9H,(H,21,22)