7-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-4-ethyl-1H-quinoxaline-2,3-dione

Systemtic Name: 7-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-4-ethyl-1H-quinoxaline-2,3-dione Openeye Name: 7-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-dione CAS Name: 7-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-oxomethyl]-4-ethyl-1H-quinoxaline-2,3-dione IUPAC Name: 7-[4-(5-bromopyridin-2-yl)piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-dione Traditional Name: 7-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-quinone Formula: C20H20BrN5O3 MolecularWeight: 458.3085

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)Br)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)Br)NC(=O)C1=O

InChI

InChI=1S/C20H20BrN5O3/c1-2-26-16-5-3-13(11-15(16)23-18(27)20(26)29)19(28)25-9-7-24(8-10-25)17-6-4-14(21)12-22-17/h3-6,11-12H,2,7-10H2,1H3,(H,23,27)