(3E,6S)-3-[(2-bromophenyl)methylidene]-6-methyl-piperazine-2,5-dione

Systemtic Name: (3E,6S)-3-[(2-bromophenyl)methylidene]-6-methyl-piperazine-2,5-dione Openeye Name: (3E,6S)-3-[(2-bromophenyl)methylene]-6-methyl-piperazine-2,5-dione CAS Name: (3E,6S)-3-[(2-bromophenyl)methylidene]-6-methylpiperazine-2,5-dione IUPAC Name: (3E,6S)-3-[(2-bromophenyl)methylidene]-6-methylpiperazine-2,5-dione Traditional Name: (3E,6S)-3-(2-bromobenzylidene)-6-methyl-piperazine-2,5-quinone Formula: C12H11BrN2O2 MolecularWeight: 295.13194

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(=CC2=CC=CC=C2Br)C(=O)N1

Isomeric SMILES

C[C@H]1C(=O)N/C(=C/C2=CC=CC=C2Br)/C(=O)N1

InChI

InChI=1S/C12H11BrN2O2/c1-7-11(16)15-10(12(17)14-7)6-8-4-2-3-5-9(8)13/h2-7H,1H3,(H,14,17)(H,15,16)/b10-6+/t7-/m0/s1