[1-(2-nitrophenyl)piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O3/c27-19(24-12-14-25(15-13-24)20-21-8-3-9-22-20)16-6-10-23(11-7-16)17-4-1-2-5-18(17)26(28)29/h1-5,8-9,16H,6-7,10-15H2