diazanium 6-chloranyl-5-(4-phosphonatobutyl)-1H-pyrimidine-2,4-dione

Systemtic Name: diazanium 6-chloranyl-5-(4-phosphonatobutyl)-1H-pyrimidine-2,4-dione Openeye Name: diammonium 6-chloro-5-(4-phosphonatobutyl)-1H-pyrimidine-2,4-dione CAS Name: diammonium 6-chloro-5-(4-phosphonatobutyl)-1H-pyrimidine-2,4-dione IUPAC Name: diazanium 6-chloro-5-(4-phosphonatobutyl)-1H-pyrimidine-2,4-dione Traditional Name: diammonium 6-chloro-5-(4-phosphonatobutyl)uracil Formula: C8H18ClN4O5P MolecularWeight: 316.679081

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Descriptors Computed from Structure

Canonical SMILES:

C(CCP(=O)([O-])[O-])CC1=C(NC(=O)NC1=O)Cl.[NH4+].[NH4+]

Isomeric SMILES

C(CCP(=O)([O-])[O-])CC1=C(NC(=O)NC1=O)Cl.[NH4+].[NH4+]

InChI

InChI=1S/C8H12ClN2O5P.2H3N/c9-6-5(7(12)11-8(13)10-6)3-1-2-4-17(14,15)16;;/h1-4H2,(H2,14,15,16)(H2,10,11,12,13);2*1H3