1,3-dimethyl-6-[4-(4-nitro-3-oxidanylidene-butyl)piperazin-1-yl]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-[4-(4-nitro-3-oxidanylidene-butyl)piperazin-1-yl]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-6-[4-(4-nitro-3-oxo-butyl)piperazin-1-yl]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-6-[4-(4-nitro-3-oxobutyl)-1-piperazinyl]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-6-[4-(4-nitro-3-oxobutyl)piperazin-1-yl]pyrimidine-2,4-dione Traditional Name: 6-[4-(3-keto-4-nitro-butyl)piperazino]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C14H21N5O5 MolecularWeight: 339.34704

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCC(=O)C[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCC(=O)C[N+](=O)[O-]

InChI

InChI=1S/C14H21N5O5/c1-15-12(9-13(21)16(2)14(15)22)18-7-5-17(6-8-18)4-3-11(20)10-19(23)24/h9H,3-8,10H2,1-2H3