[(2S)-3-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-2-chloranyl-oxolan-2-yl]phosphonic acid

Systemtic Name: [(2S)-3-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-2-chloranyl-oxolan-2-yl]phosphonic acid Openeye Name: [(2S)-3-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2-chloro-tetrahydrofuran-2-yl]phosphonic acid CAS Name: [(2S)-3-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2-chloro-2-oxolanyl]phosphonic acid IUPAC Name: [(2S)-3-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2-chlorooxolan-2-yl]phosphonic acid Traditional Name: [(2S)-3-[(2-amino-6-keto-3H-purin-9-yl)methyl]-2-chloro-tetrahydrofuran-2-yl]phosphonic acid Formula: C10H13ClN5O5P MolecularWeight: 349.667481

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C1CN2C=NC3=C2NC(=NC3=O)N)(P(=O)(O)O)Cl

Isomeric SMILES

C1CO[C@@](C1CN2C=NC3=C2NC(=NC3=O)N)(P(=O)(O)O)Cl

InChI

InChI=1S/C10H13ClN5O5P/c11-10(22(18,19)20)5(1-2-21-10)3-16-4-13-6-7(16)14-9(12)15-8(6)17/h4-5H,1-3H2,(H2,18,19,20)(H3,12,14,15,17)/t5?,10-/m0/s1