5-nitro-1,3-bis[(2-oxidanylideneazepan-1-yl)methyl]pyrimidine-2,4-dione

Systemtic Name: 5-nitro-1,3-bis[(2-oxidanylideneazepan-1-yl)methyl]pyrimidine-2,4-dione Openeye Name: 5-nitro-1,3-bis[(2-oxoazepan-1-yl)methyl]pyrimidine-2,4-dione CAS Name: 5-nitro-1,3-bis[(2-oxo-1-azepanyl)methyl]pyrimidine-2,4-dione IUPAC Name: 5-nitro-1,3-bis[(2-oxoazepan-1-yl)methyl]pyrimidine-2,4-dione Traditional Name: 1,3-bis[(2-ketoazepan-1-yl)methyl]-5-nitro-pyrimidine-2,4-quinone Formula: C18H25N5O6 MolecularWeight: 407.421

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CN2C=C(C(=O)N(C2=O)CN3CCCCCC3=O)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=O)N(CC1)CN2C=C(C(=O)N(C2=O)CN3CCCCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O6/c24-15-7-3-1-5-9-19(15)12-21-11-14(23(28)29)17(26)22(18(21)27)13-20-10-6-2-4-8-16(20)25/h11H,1-10,12-13H2