2-[3,5-bis(chloranyl)-4-[[4-(2-fluoranylpropan-2-yl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[3,5-bis(chloranyl)-4-[[4-(2-fluoranylpropan-2-yl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[3,5-dichloro-4-[[4-(1-fluoro-1-methyl-ethyl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[3,5-dichloro-4-[[4-(2-fluoropropan-2-yl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[3,5-dichloro-4-[[4-(2-fluoropropan-2-yl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[3,5-dichloro-4-[4-(1-fluoro-1-methyl-ethyl)benzyl]phenyl]-1,2,4-triazine-3,5-quinone Formula: C19H16Cl2FN3O2 MolecularWeight: 408.253643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)CC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl)F

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)CC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl)F

InChI

InChI=1S/C19H16Cl2FN3O2/c1-19(2,22)12-5-3-11(4-6-12)7-14-15(20)8-13(9-16(14)21)25-18(27)24-17(26)10-23-25/h3-6,8-10H,7H2,1-2H3,(H,24,26,27)