2-[4-(4-chlorophenyl)carbonyl-3,5-dimethyl-phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[4-(4-chlorophenyl)carbonyl-3,5-dimethyl-phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[4-(4-chlorobenzoyl)-3,5-dimethyl-phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-3,5-dimethylphenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[4-(4-chlorobenzoyl)-3,5-dimethylphenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[4-(4-chlorobenzoyl)-3,5-dimethyl-phenyl]-1,2,4-triazine-3,5-quinone Formula: C18H14ClN3O3 MolecularWeight: 355.77506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)C)N3C(=O)NC(=O)C=N3

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)C)N3C(=O)NC(=O)C=N3

InChI

InChI=1S/C18H14ClN3O3/c1-10-7-14(22-18(25)21-15(23)9-20-22)8-11(2)16(10)17(24)12-3-5-13(19)6-4-12/h3-9H,1-2H3,(H,21,23,25)