2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl 2-phenylazanylpropanoate

Systemtic Name: 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl 2-phenylazanylpropanoate Openeye Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl 2-anilinopropanoate CAS Name: 2-anilinopropanoic acid 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl ester IUPAC Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl 2-anilinopropanoate Traditional Name: 2-anilinopropionic acid 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl ester Formula: C17H20N6O4 MolecularWeight: 372.3785

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)NC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)NC3=CC=CC=C3

InChI

InChI=1S/C17H20N6O4/c1-11(20-12-5-3-2-4-6-12)16(25)27-8-7-26-10-23-9-19-13-14(23)21-17(18)22-15(13)24/h2-6,9,11,20H,7-8,10H2,1H3,(H3,18,21,22,24)