3-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyridazin-6-one CAS Name: 3-[4-(4-nitrophenyl)-1-piperazinyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[4-(4-nitrophenyl)piperazino]-1H-pyridazin-6-one Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O3/c20-14-6-5-13(15-16-14)18-9-7-17(8-10-18)11-1-3-12(4-2-11)19(21)22/h1-6H,7-10H2,(H,16,20)