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

Systemtic Name: 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl (2S)-2-azanylbutanoate Openeye Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl (2S)-2-aminobutanoate CAS Name: (2S)-2-aminobutanoic 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 (2S)-2-aminobutanoate Traditional Name: (2S)-2-aminobutyric acid 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl ester Formula: C12H18N6O4 MolecularWeight: 310.30912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)N

Isomeric SMILES

CC[C@@H](C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)N

InChI

InChI=1S/C12H18N6O4/c1-2-7(13)11(20)22-4-3-21-6-18-5-15-8-9(18)16-12(14)17-10(8)19/h5,7H,2-4,6,13H2,1H3,(H3,14,16,17,19)/t7-/m0/s1