4-bromanyl-5-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-bromanyl-5-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-bromo-5-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-bromo-5-[4-(4-nitrophenyl)-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-bromo-5-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-bromo-5-[4-(4-nitrophenyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C20H18BrN5O3 MolecularWeight: 456.29262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C20H18BrN5O3/c21-19-18(14-22-25(20(19)27)16-4-2-1-3-5-16)24-12-10-23(11-13-24)15-6-8-17(9-7-15)26(28)29/h1-9,14H,10-13H2