2-[4-[(4-chlorophenyl)-oxidanyl-methyl]-3-methyl-phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[4-[(4-chlorophenyl)-oxidanyl-methyl]-3-methyl-phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[4-[(4-chlorophenyl)-hydroxy-methyl]-3-methyl-phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[4-[(4-chlorophenyl)-hydroxymethyl]-3-methylphenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[4-[(4-chlorophenyl)-hydroxymethyl]-3-methylphenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[4-[(4-chlorophenyl)-hydroxy-methyl]-3-methyl-phenyl]-1,2,4-triazine-3,5-quinone Formula: C17H14ClN3O3 MolecularWeight: 343.76436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)NC(=O)C=N2)C(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)NC(=O)C=N2)C(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C17H14ClN3O3/c1-10-8-13(21-17(24)20-15(22)9-19-21)6-7-14(10)16(23)11-2-4-12(18)5-3-11/h2-9,16,23H,1H3,(H,20,22,24)