2-[(2E)-2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid

Systemtic Name: 2-[(2E)-2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid Openeye Name: 2-[(2E)-2-[(2-amino-6-oxo-3H-purin-9-yl)methylene]cyclopropyl]ethylphosphonic acid CAS Name: 2-[(2E)-2-[(2-amino-6-oxo-3H-purin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid IUPAC Name: 2-[(2E)-2-[(2-amino-6-oxo-3H-purin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid Traditional Name: 2-[(2E)-2-[(2-amino-6-keto-3H-purin-9-yl)methylene]cyclopropyl]ethylphosphonic acid Formula: C11H14N5O4P MolecularWeight: 311.233721

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1=CN2C=NC3=C2NC(=NC3=O)N)CCP(=O)(O)O

Isomeric SMILES

C\1C(/C1=C/N2C=NC3=C2NC(=NC3=O)N)CCP(=O)(O)O

InChI

InChI=1S/C11H14N5O4P/c12-11-14-9-8(10(17)15-11)13-5-16(9)4-7-3-6(7)1-2-21(18,19)20/h4-6H,1-3H2,(H2,18,19,20)(H3,12,14,15,17)/b7-4+