(2-nitrophenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (2-nitrophenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (2-nitrophenyl)-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (2-nitrophenyl)-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (2-nitrophenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (2-nitrophenyl)-[4-(6-piperidinopyrimidin-4-yl)piperazino]methanone Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O3/c27-20(16-6-2-3-7-17(16)26(28)29)25-12-10-24(11-13-25)19-14-18(21-15-22-19)23-8-4-1-5-9-23/h2-3,6-7,14-15H,1,4-5,8-13H2