[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]phenyl]methoxymethyl-oxidanyl-phosphinate

Systemtic Name: [2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]phenyl]methoxymethyl-oxidanyl-phosphinate Openeye Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]phenyl]methoxymethyl-hydroxy-phosphinate CAS Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]phenyl]methoxymethyl-hydroxyphosphinate IUPAC Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]phenyl]methoxymethyl-hydroxyphosphinate Traditional Name: [2-[(2-amino-6-keto-3H-purin-9-yl)methyl]benzyl]oxymethyl-hydroxy-phosphinate Formula: C14H15N5O5P- MolecularWeight: 364.273161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C2NC(=NC3=O)N)COCP(=O)(O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C2NC(=NC3=O)N)COCP(=O)(O)[O-]

InChI

InChI=1S/C14H16N5O5P/c15-14-17-12-11(13(20)18-14)16-7-19(12)5-9-3-1-2-4-10(9)6-24-8-25(21,22)23/h1-4,7H,5-6,8H2,(H2,21,22,23)(H3,15,17,18,20)/p-1