[1-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-nonoxy-3-oxidanyl-oxolan-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethyl] 2-methylpropanoate

Systemtic Name: [1-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-nonoxy-3-oxidanyl-oxolan-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethyl] 2-methylpropanoate Openeye Name: [1-[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-4-nonoxy-tetrahydrofuran-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [1-[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-4-nonoxy-2-oxolanyl]-2,2-bis(4-methoxyphenyl)-2-phenylethyl] ester IUPAC Name: [1-[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-4-nonoxyoxolan-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenylethyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [1-[5-(2-amino-6-keto-3H-purin-9-yl)-3-hydroxy-4-nonoxy-tetrahydrofuran-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethyl] ester Formula: C44H55N5O8 MolecularWeight: 781.9362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)C(C(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OC(=O)C(C)C)O

Isomeric SMILES

CCCCCCCCCOC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)C(C(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OC(=O)C(C)C)O

InChI

InChI=1S/C44H55N5O8/c1-6-7-8-9-10-11-15-26-55-37-35(50)36(56-41(37)49-27-46-34-39(49)47-43(45)48-40(34)51)38(57-42(52)28(2)3)44(29-16-13-12-14-17-29,30-18-22-32(53-4)23-19-30)31-20-24-33(54-5)25-21-31/h12-14,16-25,27-28,35-38,41,50H,6-11,15,26H2,1-5H3,(H3,45,47,48,51)