[(E)-4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)but-1-enyl]phosphonic acid

Systemtic Name: [(E)-4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)but-1-enyl]phosphonic acid Openeye Name: [(E)-4-(4-amino-2-oxo-pyrimidin-1-yl)but-1-enyl]phosphonic acid CAS Name: [(E)-4-(4-amino-2-oxo-1-pyrimidinyl)but-1-enyl]phosphonic acid IUPAC Name: [(E)-4-(4-amino-2-oxopyrimidin-1-yl)but-1-enyl]phosphonic acid Traditional Name: [(E)-4-(4-amino-2-keto-pyrimidin-1-yl)but-1-enyl]phosphonic acid Formula: C8H12N3O4P MolecularWeight: 245.172341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)CCC=CP(=O)(O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)CC/C=C/P(=O)(O)O

InChI

InChI=1S/C8H12N3O4P/c9-7-3-5-11(8(12)10-7)4-1-2-6-16(13,14)15/h2-3,5-6H,1,4H2,(H2,9,10,12)(H2,13,14,15)/b6-2+