2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl 3-(3-decylsulfonyldodecan-2-yloxy)propyl hydrogen phosphate

Systemtic Name: 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl 3-(3-decylsulfonyldodecan-2-yloxy)propyl hydrogen phosphate Openeye Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl 3-(2-decylsulfonyl-1-methyl-undecoxy)propyl hydrogen phosphate CAS Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl 3-(3-decylsulfonyldodecan-2-yloxy)propyl hydrogen phosphate IUPAC Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl 3-(3-decylsulfonyldodecan-2-yloxy)propyl hydrogen phosphate Traditional Name: 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl 3-(2-decylsulfonyl-1-methyl-undecoxy)propyl hydrogen phosphate Formula: C33H62N5O9PS MolecularWeight: 735.912241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCS(=O)(=O)C(CCCCCCCCC)C(C)OCCCOP(=O)(O)OCCOCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CCCCCCCCCCS(=O)(=O)C(CCCCCCCCC)C(C)OCCCOP(=O)(O)OCCOCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C33H62N5O9PS/c1-4-6-8-10-12-14-16-18-25-49(42,43)29(20-17-15-13-11-9-7-5-2)28(3)45-21-19-22-46-48(40,41)47-24-23-44-27-38-26-35-30-31(38)36-33(34)37-32(30)39/h26,28-29H,4-25,27H2,1-3H3,(H,40,41)(H3,34,36,37,39)