O5-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl] O1-(phenylmethyl) 2-(phenylmethoxycarbonylamino)pentanedioate

Systemtic Name: O5-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl] O1-(phenylmethyl) 2-(phenylmethoxycarbonylamino)pentanedioate Openeye Name: O5-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] O1-benzyl 2-(benzyloxycarbonylamino)pentanedioate CAS Name: 2-(phenylmethoxycarbonylamino)pentanedioic acid O5-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] ester O1-(phenylmethyl) ester IUPAC Name: 5-O-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] 1-O-benzyl 2-(phenylmethoxycarbonylamino)pentanedioate Traditional Name: 2-(benzyloxycarbonylamino)glutaric acid O5-[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl] ester O1-benzyl ester Formula: C28H30N6O8 MolecularWeight: 578.5732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCC(=O)OCCOCN2C=NC3=C2NC(=NC3=O)N)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CCC(=O)OCCOCN2C=NC3=C2NC(=NC3=O)N)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H30N6O8/c29-27-32-24-23(25(36)33-27)30-17-34(24)18-39-13-14-40-22(35)12-11-21(26(37)41-15-19-7-3-1-4-8-19)31-28(38)42-16-20-9-5-2-6-10-20/h1-10,17,21H,11-16,18H2,(H,31,38)(H3,29,32,33,36)