propyl 2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-methoxy-3-phenylmethoxy-propanoate

Systemtic Name: propyl 2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-methoxy-3-phenylmethoxy-propanoate Openeye Name: propyl 2-(2-amino-6-oxo-3H-purin-9-yl)-3-benzyloxy-2-methoxy-propanoate CAS Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-2-methoxy-3-phenylmethoxypropanoic acid propyl ester IUPAC Name: propyl 2-(2-amino-6-oxo-3H-purin-9-yl)-2-methoxy-3-phenylmethoxypropanoate Traditional Name: 2-(2-amino-6-keto-3H-purin-9-yl)-3-benzoxy-2-methoxy-propionic acid propyl ester Formula: C19H23N5O5 MolecularWeight: 401.41642

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(COCC1=CC=CC=C1)(N2C=NC3=C2NC(=NC3=O)N)OC

Isomeric SMILES

CCCOC(=O)C(COCC1=CC=CC=C1)(N2C=NC3=C2NC(=NC3=O)N)OC

InChI

InChI=1S/C19H23N5O5/c1-3-9-29-17(26)19(27-2,11-28-10-13-7-5-4-6-8-13)24-12-21-14-15(24)22-18(20)23-16(14)25/h4-8,12H,3,9-11H2,1-2H3,(H3,20,22,23,25)