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

Systemtic Name: 2-[3,5-bis(chloranyl)-4-[[4-(2-hydroxyethyl)phenyl]methyl]phenyl]-4-ethanoyl-1,2,4-triazine-3,5-dione Openeye Name: 4-acetyl-2-[3,5-dichloro-4-[[4-(2-hydroxyethyl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione CAS Name: 4-acetyl-2-[3,5-dichloro-4-[[4-(2-hydroxyethyl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 4-acetyl-2-[3,5-dichloro-4-[[4-(2-hydroxyethyl)phenyl]methyl]phenyl]-1,2,4-triazine-3,5-dione Traditional Name: 4-acetyl-2-[3,5-dichloro-4-[4-(2-hydroxyethyl)benzyl]phenyl]-1,2,4-triazine-3,5-quinone Formula: C20H17Cl2N3O4 MolecularWeight: 434.27268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=O)C=NN(C1=O)C2=CC(=C(C(=C2)Cl)CC3=CC=C(C=C3)CCO)Cl

Isomeric SMILES

CC(=O)N1C(=O)C=NN(C1=O)C2=CC(=C(C(=C2)Cl)CC3=CC=C(C=C3)CCO)Cl

InChI

InChI=1S/C20H17Cl2N3O4/c1-12(27)24-19(28)11-23-25(20(24)29)15-9-17(21)16(18(22)10-15)8-14-4-2-13(3-5-14)6-7-26/h2-5,9-11,26H,6-8H2,1H3