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

Systemtic Name: 4-[6-[4-(2,6-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]morpholine Openeye Name: 4-[6-[4-(2,6-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]morpholine CAS Name: 4-[6-[4-(2,6-dimethylphenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-[4-(2,6-dimethylphenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]morpholine Traditional Name: 4-[6-[4-(2,6-dimethylphenyl)piperazino]-5-nitro-pyrimidin-4-yl]morpholine Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CCN(CC2)C3=C(C(=NC=N3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CCN(CC2)C3=C(C(=NC=N3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O3/c1-15-4-3-5-16(2)17(15)23-6-8-24(9-7-23)19-18(26(27)28)20(22-14-21-19)25-10-12-29-13-11-25/h3-5,14H,6-13H2,1-2H3