3-[2-[2-nitro-4-(phenylcarbonyl)phenyl]ethyl]-1-piperazin-1-yl-pyrimidine-2,4-dione

Systemtic Name: 3-[2-[2-nitro-4-(phenylcarbonyl)phenyl]ethyl]-1-piperazin-1-yl-pyrimidine-2,4-dione Openeye Name: 3-[2-(4-benzoyl-2-nitro-phenyl)ethyl]-1-piperazin-1-yl-pyrimidine-2,4-dione CAS Name: 3-[2-(4-benzoyl-2-nitrophenyl)ethyl]-1-(1-piperazinyl)pyrimidine-2,4-dione IUPAC Name: 3-[2-(4-benzoyl-2-nitrophenyl)ethyl]-1-piperazin-1-ylpyrimidine-2,4-dione Traditional Name: 3-[2-(4-benzoyl-2-nitro-phenyl)ethyl]-1-piperazino-pyrimidine-2,4-quinone Formula: C23H23N5O5 MolecularWeight: 449.45922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)N2C=CC(=O)N(C2=O)CCC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)N2C=CC(=O)N(C2=O)CCC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N5O5/c29-21-9-13-27(25-14-10-24-11-15-25)23(31)26(21)12-8-17-6-7-19(16-20(17)28(32)33)22(30)18-4-2-1-3-5-18/h1-7,9,13,16,24H,8,10-12,14-15H2