5-nitro-6-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 5-nitro-6-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one Openeye Name: 5-nitro-6-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one CAS Name: 5-nitro-6-(4-phenyl-1-piperazinyl)-1H-pyrimidin-4-one IUPAC Name: 5-nitro-6-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one Traditional Name: 5-nitro-6-(4-phenylpiperazino)-1H-pyrimidin-4-one Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N=CN3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N=CN3)[N+](=O)[O-]

InChI

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