methyl 2-[[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-phenoxy-phosphoryl]amino]ethanoate

Systemtic Name: methyl 2-[[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-phenoxy-phosphoryl]amino]ethanoate Openeye Name: methyl 2-[[[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-phenoxy-phosphoryl]amino]acetate CAS Name: 2-[[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-phenoxyphosphoryl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-phenoxyphosphoryl]amino]acetate Traditional Name: 2-[[[(1R)-2-adenin-9-yl-1-methyl-ethoxy]methyl-phenoxy-phosphoryl]amino]acetic acid methyl ester Formula: C18H23N6O5P MolecularWeight: 434.386181

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=CN=C2N)OCP(=O)(NCC(=O)OC)OC3=CC=CC=C3

Isomeric SMILES

C[C@H](CN1C=NC2=C1N=CN=C2N)OCP(=O)(NCC(=O)OC)OC3=CC=CC=C3

InChI

InChI=1S/C18H23N6O5P/c1-13(9-24-11-22-16-17(19)20-10-21-18(16)24)28-12-30(26,23-8-15(25)27-2)29-14-6-4-3-5-7-14/h3-7,10-11,13H,8-9,12H2,1-2H3,(H,23,26)(H2,19,20,21)/t13-,30?/m1/s1