[[4-oxidanyl-3-(6-phenylazanylpurin-9-yl)butoxy]methyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate

Systemtic Name: [[4-oxidanyl-3-(6-phenylazanylpurin-9-yl)butoxy]methyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate Openeye Name: [[3-(6-anilinopurin-9-yl)-4-hydroxy-butoxy]methyl-(isopropoxycarbonyloxymethoxy)phosphoryl]oxymethyl isopropyl carbonate CAS Name: carbonic acid [[3-(6-anilino-9-purinyl)-4-hydroxybutoxy]methyl-[[oxo(propan-2-yloxy)methoxy]methoxy]phosphoryl]oxymethyl propan-2-yl ester IUPAC Name: [[3-(6-anilinopurin-9-yl)-4-hydroxybutoxy]methyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate Traditional Name: carbonic acid [[3-(6-anilinopurin-9-yl)-4-hydroxy-butoxy]methyl-(isopropoxycarbonyloxymethoxy)phosphoryl]oxymethyl isopropyl ester Formula: C26H36N5O11P MolecularWeight: 625.564701

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)OCOP(=O)(COCCC(CO)N1C=NC2=C1N=CN=C2NC3=CC=CC=C3)OCOC(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)OCOP(=O)(COCCC(CO)N1C=NC2=C1N=CN=C2NC3=CC=CC=C3)OCOC(=O)OC(C)C

InChI

InChI=1S/C26H36N5O11P/c1-18(2)41-25(33)37-15-39-43(35,40-16-38-26(34)42-19(3)4)17-36-11-10-21(12-32)31-14-29-22-23(27-13-28-24(22)31)30-20-8-6-5-7-9-20/h5-9,13-14,18-19,21,32H,10-12,15-17H2,1-4H3,(H,27,28,30)