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

Systemtic Name: propyl 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-phenylmethoxy-propanoate Openeye Name: propyl 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-benzyloxy-propanoate CAS Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-phenylmethoxypropanoic acid propyl ester IUPAC Name: propyl 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-phenylmethoxypropanoate Traditional Name: 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]-3-benzoxy-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)OCN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CCCOC(=O)C(COCC1=CC=CC=C1)OCN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C19H23N5O5/c1-2-8-28-18(26)14(10-27-9-13-6-4-3-5-7-13)29-12-24-11-21-15-16(24)22-19(20)23-17(15)25/h3-7,11,14H,2,8-10,12H2,1H3,(H3,20,22,23,25)