[4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)butyl] diphenyl phosphate

Systemtic Name: [4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)butyl] diphenyl phosphate Openeye Name: [4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butyl] diphenyl phosphate CAS Name: phosphoric acid [4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butyl] diphenyl ester IUPAC Name: [4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butyl] diphenyl phosphate Traditional Name: phosphoric acid [4-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-butyl] diphenyl ester Formula: C22H24N5O6P MolecularWeight: 485.429621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(OCC(CCN2C=NC3=C2NC(=NC3=O)N)CO)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(OCC(CCN2C=NC3=C2NC(=NC3=O)N)CO)OC4=CC=CC=C4

InChI

InChI=1S/C22H24N5O6P/c23-22-25-20-19(21(29)26-22)24-15-27(20)12-11-16(13-28)14-31-34(30,32-17-7-3-1-4-8-17)33-18-9-5-2-6-10-18/h1-10,15-16,28H,11-14H2,(H3,23,25,26,29)