propan-2-yl (2S)-2-[[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-phenoxy-phosphoryl]amino]propanoate

Systemtic Name: propan-2-yl (2S)-2-[[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-phenoxy-phosphoryl]amino]propanoate Openeye Name: isopropyl (2S)-2-[[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-phenoxy-phosphoryl]amino]propanoate CAS Name: (2S)-2-[[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-phenoxyphosphoryl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-[[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-phenoxyphosphoryl]amino]propanoate Traditional Name: (2S)-2-[[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethoxy-phenoxy-phosphoryl]amino]propionic acid isopropyl ester Formula: C20H27N6O7P MolecularWeight: 494.438141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C)NP(=O)(OCCOCN1C=NC2=C1NC(=NC2=O)N)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OC(C)C)NP(=O)(OCCOCN1C=NC2=C1NC(=NC2=O)N)OC3=CC=CC=C3

InChI

InChI=1S/C20H27N6O7P/c1-13(2)32-19(28)14(3)25-34(29,33-15-7-5-4-6-8-15)31-10-9-30-12-26-11-22-16-17(26)23-20(21)24-18(16)27/h4-8,11,13-14H,9-10,12H2,1-3H3,(H,25,29)(H3,21,23,24,27)/t14-,34?/m0/s1