(phenylmethyl) N-[1-[[5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]amino]-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[[5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]amino]-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[(5-adenin-9-yl-4-hydroxy-2-methylol-tetrahydrofuran-3-yl)amino]-2-keto-1-p-anisyl-ethyl]carbamic acid benzyl ester Formula: C28H31N7O7 MolecularWeight: 577.58844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)NC2C(OC(C2O)N3C=NC4=C3N=CN=C4N)CO)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)NC2C(OC(C2O)N3C=NC4=C3N=CN=C4N)CO)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H31N7O7/c1-40-18-9-7-16(8-10-18)11-19(33-28(39)41-13-17-5-3-2-4-6-17)26(38)34-21-20(12-36)42-27(23(21)37)35-15-32-22-24(29)30-14-31-25(22)35/h2-10,14-15,19-21,23,27,36-37H,11-13H2,1H3,(H,33,39)(H,34,38)(H2,29,30,31)