2,6-dimethoxy-4-[(Z)-1-phosphonato-2-(pyrimidin-2-ylamino)ethenyl]phenol

Systemtic Name: 2,6-dimethoxy-4-[(Z)-1-phosphonato-2-(pyrimidin-2-ylamino)ethenyl]phenol Openeye Name: 2,6-dimethoxy-4-[(Z)-1-phosphonato-2-(pyrimidin-2-ylamino)vinyl]phenol CAS Name: 2,6-dimethoxy-4-[(Z)-1-phosphonato-2-(2-pyrimidinylamino)ethenyl]phenol IUPAC Name: 2,6-dimethoxy-4-[(Z)-1-phosphonato-2-(pyrimidin-2-ylamino)ethenyl]phenol Traditional Name: 2,6-dimethoxy-4-[(Z)-1-phosphonato-2-(2-pyrimidylamino)vinyl]phenol Formula: C14H14N3O6P-2 MolecularWeight: 351.251221

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C(=CNC2=NC=CC=N2)P(=O)([O-])[O-]

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)/C(=C/NC2=NC=CC=N2)/P(=O)([O-])[O-]

InChI

InChI=1S/C14H16N3O6P/c1-22-10-6-9(7-11(23-2)13(10)18)12(24(19,20)21)8-17-14-15-4-3-5-16-14/h3-8,18H,1-2H3,(H,15,16,17)(H2,19,20,21)/p-2/b12-8-