2-(2,4-dichlorophenyl)-6-methyl-4,4-bis(trifluoromethyl)-1H-pyrimidin-3-ium-5-carbonitrile

Systemtic Name: 2-(2,4-dichlorophenyl)-6-methyl-4,4-bis(trifluoromethyl)-1H-pyrimidin-3-ium-5-carbonitrile Openeye Name: 2-(2,4-dichlorophenyl)-6-methyl-4,4-bis(trifluoromethyl)-1H-pyrimidin-3-ium-5-carbonitrile CAS Name: 2-(2,4-dichlorophenyl)-6-methyl-4,4-bis(trifluoromethyl)-1H-pyrimidin-3-ium-5-carbonitrile IUPAC Name: 2-(2,4-dichlorophenyl)-6-methyl-4,4-bis(trifluoromethyl)-1H-pyrimidin-3-ium-5-carbonitrile Traditional Name: 2-(2,4-dichlorophenyl)-6-methyl-4,4-bis(trifluoromethyl)-1H-pyrimidin-3-ium-5-carbonitrile Formula: C14H8Cl2F6N3+ MolecularWeight: 403.129839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C([NH+]=C(N1)C2=C(C=C(C=C2)Cl)Cl)(C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C([NH+]=C(N1)C2=C(C=C(C=C2)Cl)Cl)(C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C14H7Cl2F6N3/c1-6-9(5-23)12(13(17,18)19,14(20,21)22)25-11(24-6)8-3-2-7(15)4-10(8)16/h2-4H,1H3,(H,24,25)/p+1