disodium 5-chloranyl-1-[(Z)-4-phosphonatobut-2-enyl]pyrimidine-2,4-dione

Systemtic Name: disodium 5-chloranyl-1-[(Z)-4-phosphonatobut-2-enyl]pyrimidine-2,4-dione Openeye Name: disodium 5-chloro-1-[(Z)-4-phosphonatobut-2-enyl]pyrimidine-2,4-dione CAS Name: disodium 5-chloro-1-[(Z)-4-phosphonatobut-2-enyl]pyrimidine-2,4-dione IUPAC Name: disodium 5-chloro-1-[(Z)-4-phosphonatobut-2-enyl]pyrimidine-2,4-dione Traditional Name: disodium 5-chloro-1-[(Z)-4-phosphonatobut-2-enyl]pyrimidine-2,4-quinone Formula: C8H8ClN2Na2O5P MolecularWeight: 324.565821

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=O)N1CC=CCP(=O)([O-])[O-])Cl.[Na+].[Na+]

Isomeric SMILES

C1=C(C(=O)NC(=O)N1C/C=C\CP(=O)([O-])[O-])Cl.[Na+].[Na+]

InChI

InChI=1S/C8H10ClN2O5P.2Na/c9-6-5-11(8(13)10-7(6)12)3-1-2-4-17(14,15)16;;/h1-2,5H,3-4H2,(H,10,12,13)(H2,14,15,16);;/q;2*+1/p-2/b2-1-;;