3-(2-azanyl-5-bromanyl-pyrimidin-4-yl)pentan-3-ylphosphonic acid

Systemtic Name: 3-(2-azanyl-5-bromanyl-pyrimidin-4-yl)pentan-3-ylphosphonic acid Openeye Name: [1-(2-amino-5-bromo-pyrimidin-4-yl)-1-ethyl-propyl]phosphonic acid CAS Name: 3-(2-amino-5-bromo-4-pyrimidinyl)pentan-3-ylphosphonic acid IUPAC Name: 3-(2-amino-5-bromopyrimidin-4-yl)pentan-3-ylphosphonic acid Traditional Name: [1-(2-amino-5-bromo-pyrimidin-4-yl)-1-ethyl-propyl]phosphonic acid Formula: C9H15BrN3O3P MolecularWeight: 324.111461

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=NC(=NC=C1Br)N)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=NC(=NC=C1Br)N)P(=O)(O)O

InChI

InChI=1S/C9H15BrN3O3P/c1-3-9(4-2,17(14,15)16)7-6(10)5-12-8(11)13-7/h5H,3-4H2,1-2H3,(H2,11,12,13)(H2,14,15,16)