(1-oxidanidylpyridin-1-ium-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (1-oxidanidylpyridin-1-ium-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (1-oxidopyridin-1-ium-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (1-oxido-3-pyridin-1-iumyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (1-oxidopyridin-1-ium-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-oxidopyridin-1-ium-3-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C14H15N5O2 MolecularWeight: 285.3012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C14H15N5O2/c20-13(12-3-1-6-19(21)11-12)17-7-9-18(10-8-17)14-15-4-2-5-16-14/h1-6,11H,7-10H2