3-phenylmethoxypropyl 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethanoate

Systemtic Name: 3-phenylmethoxypropyl 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethanoate Openeye Name: 3-benzyloxypropyl 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]acetate CAS Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]acetic acid 3-phenylmethoxypropyl ester IUPAC Name: 3-phenylmethoxypropyl 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]acetate Traditional Name: 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]acetic acid 3-benzoxypropyl ester Formula: C18H21N5O5 MolecularWeight: 387.38984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCOC(=O)COCN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

C1=CC=C(C=C1)COCCCOC(=O)COCN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C18H21N5O5/c19-18-21-16-15(17(25)22-18)20-11-23(16)12-27-10-14(24)28-8-4-7-26-9-13-5-2-1-3-6-13/h1-3,5-6,11H,4,7-10,12H2,(H3,19,21,22,25)