2-[4-(4-bromanyl-2-methyl-phenyl)carbonyl-3-chloranyl-phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[4-(4-bromanyl-2-methyl-phenyl)carbonyl-3-chloranyl-phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[4-(4-bromo-2-methyl-benzoyl)-3-chloro-phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[4-[(4-bromo-2-methylphenyl)-oxomethyl]-3-chlorophenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[4-(4-bromo-2-methylbenzoyl)-3-chlorophenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[4-(4-bromo-2-methyl-benzoyl)-3-chloro-phenyl]-1,2,4-triazine-3,5-quinone Formula: C17H11BrClN3O3 MolecularWeight: 420.64454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C(=O)C2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C(=O)C2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl

InChI

InChI=1S/C17H11BrClN3O3/c1-9-6-10(18)2-4-12(9)16(24)13-5-3-11(7-14(13)19)22-17(25)21-15(23)8-20-22/h2-8H,1H3,(H,21,23,25)