6-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-4-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 6-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[[4-(4-chlorophenyl)-1-piperazinyl]methyl]-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-4-oxo-1H-pyrimidin-2-olate Traditional Name: 6-[[4-(4-chlorophenyl)piperazino]methyl]-4-keto-1H-pyrimidin-2-olate Formula: C15H16ClN4O2- MolecularWeight: 319.76614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)N=C(N2)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)N=C(N2)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H17ClN4O2/c16-11-1-3-13(4-2-11)20-7-5-19(6-8-20)10-12-9-14(21)18-15(22)17-12/h1-4,9H,5-8,10H2,(H2,17,18,21,22)/p-1