1-[3-(hydroxymethyl)-4-[(2-oxidanylidene-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]butyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[3-(hydroxymethyl)-4-[(2-oxidanylidene-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]butyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[3-(hydroxymethyl)-4-[(2-oxo-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]butyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[3-(hydroxymethyl)-4-[(2-oxo-4H-1,3,2$l^{5}-benzodioxaphosphorin-2-yl)oxy]butyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[3-(hydroxymethyl)-4-[(2-oxo-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]butyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[4-hydroxy-3-[(2-keto-4H-1,3,2$l^{5}-benzodioxaphosphorin-2-yl)oxymethyl]butyl]-5-methyl-pyrimidine-2,4-quinone Formula: C17H21N2O7P MolecularWeight: 396.331601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CCC(CO)COP2(=O)OCC3=CC=CC=C3O2

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CCC(CO)COP2(=O)OCC3=CC=CC=C3O2

InChI

InChI=1S/C17H21N2O7P/c1-12-8-19(17(22)18-16(12)21)7-6-13(9-20)10-24-27(23)25-11-14-4-2-3-5-15(14)26-27/h2-5,8,13,20H,6-7,9-11H2,1H3,(H,18,21,22)