6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-1H-pyrimidin-4-one Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=O)N=CN3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=O)N=CN3)[N+](=O)[O-])C

InChI

InChI=1S/C16H19N5O3/c1-11-4-3-5-13(12(11)2)19-6-8-20(9-7-19)15-14(21(23)24)16(22)18-10-17-15/h3-5,10H,6-9H2,1-2H3,(H,17,18,22)