6-[4-[3-[(2-cyclopentylcarbonyl-4-nitro-phenyl)amino]propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[4-[3-[(2-cyclopentylcarbonyl-4-nitro-phenyl)amino]propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[4-[3-[2-(cyclopentanecarbonyl)-4-nitro-anilino]propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[4-[3-[2-[cyclopentyl(oxo)methyl]-4-nitroanilino]propyl]-1-piperazinyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[4-[3-[2-(cyclopentanecarbonyl)-4-nitroanilino]propyl]piperazin-1-yl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[4-[3-[2-(cyclopentanecarbonyl)-4-nitro-anilino]propyl]piperazino]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C25H34N6O5 MolecularWeight: 498.57466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCCNC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)C4CCCC4

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCCNC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)C4CCCC4

InChI

InChI=1S/C25H34N6O5/c1-27-22(17-23(32)28(2)25(27)34)30-14-12-29(13-15-30)11-5-10-26-21-9-8-19(31(35)36)16-20(21)24(33)18-6-3-4-7-18/h8-9,16-18,26H,3-7,10-15H2,1-2H3