4-phenyl-2,6-bis(trichloromethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-phenyl-2,6-bis(trichloromethyl)pyrimidine-5-carbonitrile Openeye Name: 4-phenyl-2,6-bis(trichloromethyl)pyrimidine-5-carbonitrile CAS Name: 4-phenyl-2,6-bis(trichloromethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-phenyl-2,6-bis(trichloromethyl)pyrimidine-5-carbonitrile Traditional Name: 4-phenyl-2,6-bis(trichloromethyl)pyrimidine-5-carbonitrile Formula: C13H5Cl6N3 MolecularWeight: 415.9169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)C#N

InChI

InChI=1S/C13H5Cl6N3/c14-12(15,16)10-8(6-20)9(7-4-2-1-3-5-7)21-11(22-10)13(17,18)19/h1-5H