6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-[4-(3-chlorophenyl)piperazino]-5-nitro-1H-pyrimidin-4-one Formula: C14H14ClN5O3 MolecularWeight: 335.74566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClN5O3/c15-10-2-1-3-11(8-10)18-4-6-19(7-5-18)13-12(20(22)23)14(21)17-9-16-13/h1-3,8-9H,4-7H2,(H,16,17,21)