disodium 5-chloranyl-1-[[2-(phosphonatomethyl)cyclopenten-1-yl]methyl]pyrimidine-2,4-dione

Systemtic Name: disodium 5-chloranyl-1-[[2-(phosphonatomethyl)cyclopenten-1-yl]methyl]pyrimidine-2,4-dione Openeye Name: disodium 5-chloro-1-[[2-(phosphonatomethyl)cyclopenten-1-yl]methyl]pyrimidine-2,4-dione CAS Name: disodium 5-chloro-1-[[2-(phosphonatomethyl)-1-cyclopentenyl]methyl]pyrimidine-2,4-dione IUPAC Name: disodium 5-chloro-1-[[2-(phosphonatomethyl)cyclopenten-1-yl]methyl]pyrimidine-2,4-dione Traditional Name: disodium 5-chloro-1-[[2-(phosphonatomethyl)cyclopenten-1-yl]methyl]pyrimidine-2,4-quinone Formula: C11H12ClN2Na2O5P MolecularWeight: 364.629681

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)CP(=O)([O-])[O-])CN2C=C(C(=O)NC2=O)Cl.[Na+].[Na+]

Isomeric SMILES

C1CC(=C(C1)CP(=O)([O-])[O-])CN2C=C(C(=O)NC2=O)Cl.[Na+].[Na+]

InChI

InChI=1S/C11H14ClN2O5P.2Na/c12-9-5-14(11(16)13-10(9)15)4-7-2-1-3-8(7)6-20(17,18)19;;/h5H,1-4,6H2,(H,13,15,16)(H2,17,18,19);;/q;2*+1/p-2