1-[6-[bis(chloranyl)methyl]-5-nitro-2-phenyl-pyrimidin-4-yl]benzotriazole

Systemtic Name: 1-[6-[bis(chloranyl)methyl]-5-nitro-2-phenyl-pyrimidin-4-yl]benzotriazole Openeye Name: 1-[6-(dichloromethyl)-5-nitro-2-phenyl-pyrimidin-4-yl]benzotriazole CAS Name: 1-[6-(dichloromethyl)-5-nitro-2-phenyl-4-pyrimidinyl]benzotriazole IUPAC Name: 1-[6-(dichloromethyl)-5-nitro-2-phenylpyrimidin-4-yl]benzotriazole Traditional Name: 1-[6-(dichloromethyl)-5-nitro-2-phenyl-pyrimidin-4-yl]benzotriazole Formula: C17H10Cl2N6O2 MolecularWeight: 401.2063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=N2)N3C4=CC=CC=C4N=N3)[N+](=O)[O-])C(Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=N2)N3C4=CC=CC=C4N=N3)[N+](=O)[O-])C(Cl)Cl

InChI

InChI=1S/C17H10Cl2N6O2/c18-15(19)13-14(25(26)27)17(21-16(20-13)10-6-2-1-3-7-10)24-12-9-5-4-8-11(12)22-23-24/h1-9,15H