[(E)-2-[1-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]cyclopropyl]ethenyl]phosphonic acid

Systemtic Name: [(E)-2-[1-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]cyclopropyl]ethenyl]phosphonic acid Openeye Name: [(E)-2-[1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]cyclopropyl]vinyl]phosphonic acid CAS Name: [(E)-2-[1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]cyclopropyl]ethenyl]phosphonic acid IUPAC Name: [(E)-2-[1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]cyclopropyl]ethenyl]phosphonic acid Traditional Name: [(E)-2-[1-[(2-amino-6-keto-3H-purin-9-yl)methyl]cyclopropyl]vinyl]phosphonic acid Formula: C11H14N5O4P MolecularWeight: 311.233721

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CN2C=NC3=C2NC(=NC3=O)N)C=CP(=O)(O)O

Isomeric SMILES

C1CC1(CN2C=NC3=C2NC(=NC3=O)N)/C=C/P(=O)(O)O

InChI

InChI=1S/C11H14N5O4P/c12-10-14-8-7(9(17)15-10)13-6-16(8)5-11(1-2-11)3-4-21(18,19)20/h3-4,6H,1-2,5H2,(H2,18,19,20)(H3,12,14,15,17)/b4-3+