[1-[(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)methyl]cyclopent-3-en-1-yl]methoxymethylphosphonic acid

Systemtic Name: [1-[(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)methyl]cyclopent-3-en-1-yl]methoxymethylphosphonic acid Openeye Name: [1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]cyclopent-3-en-1-yl]methoxymethylphosphonic acid CAS Name: [1-[(4-amino-2-oxo-1-pyrimidinyl)methyl]-1-cyclopent-3-enyl]methoxymethylphosphonic acid IUPAC Name: [1-[(4-amino-2-oxopyrimidin-1-yl)methyl]cyclopent-3-en-1-yl]methoxymethylphosphonic acid Traditional Name: [1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]cyclopent-3-en-1-yl]methoxymethylphosphonic acid Formula: C12H18N3O5P MolecularWeight: 315.262181

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC1(CN2C=CC(=NC2=O)N)COCP(=O)(O)O

Isomeric SMILES

C1C=CCC1(CN2C=CC(=NC2=O)N)COCP(=O)(O)O

InChI

InChI=1S/C12H18N3O5P/c13-10-3-6-15(11(16)14-10)7-12(4-1-2-5-12)8-20-9-21(17,18)19/h1-3,6H,4-5,7-9H2,(H2,13,14,16)(H2,17,18,19)