O4-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl] O1-(phenylmethyl) 2-(phenylmethoxycarbonylamino)butanedioate

Systemtic Name: O4-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl] O1-(phenylmethyl) 2-(phenylmethoxycarbonylamino)butanedioate Openeye Name: O4-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] O1-benzyl 2-(benzyloxycarbonylamino)butanedioate CAS Name: 2-(phenylmethoxycarbonylamino)butanedioic acid O4-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] ester O1-(phenylmethyl) ester IUPAC Name: 4-O-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] 1-O-benzyl 2-(phenylmethoxycarbonylamino)butanedioate Traditional Name: 2-(benzyloxycarbonylamino)succinic acid O4-[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl] ester O1-benzyl ester Formula: C27H28N6O8 MolecularWeight: 564.54662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N6O8/c28-26-31-23-22(24(35)32-26)29-16-33(23)17-38-11-12-39-21(34)13-20(25(36)40-14-18-7-3-1-4-8-18)30-27(37)41-15-19-9-5-2-6-10-19/h1-10,16,20H,11-15,17H2,(H,30,37)(H3,28,31,32,35)