5-methyl-1-[(3-nitro-2-oxidanyl-propoxy)methyl]pyrimidine-2,4-dione

Systemtic Name: 5-methyl-1-[(3-nitro-2-oxidanyl-propoxy)methyl]pyrimidine-2,4-dione Openeye Name: 1-[(2-hydroxy-3-nitro-propoxy)methyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2-hydroxy-3-nitropropoxy)methyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2-hydroxy-3-nitropropoxy)methyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2-hydroxy-3-nitro-propoxy)methyl]-5-methyl-pyrimidine-2,4-quinone Formula: C9H13N3O6 MolecularWeight: 259.21602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)COCC(C[N+](=O)[O-])O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)COCC(C[N+](=O)[O-])O

InChI

InChI=1S/C9H13N3O6/c1-6-2-11(9(15)10-8(6)14)5-18-4-7(13)3-12(16)17/h2,7,13H,3-5H2,1H3,(H,10,14,15)