[2-(2-azanylethanoyloxymethyl)-4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)butyl] 2-azanylethanoate

Systemtic Name: [2-(2-azanylethanoyloxymethyl)-4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)butyl] 2-azanylethanoate Openeye Name: [2-[(2-aminoacetyl)oxymethyl]-4-(2-amino-6-oxo-3H-purin-9-yl)butyl] 2-aminoacetate CAS Name: 2-aminoacetic acid [2-[(2-amino-1-oxoethoxy)methyl]-4-(2-amino-6-oxo-3H-purin-9-yl)butyl] ester IUPAC Name: [2-[(2-aminoacetyl)oxymethyl]-4-(2-amino-6-oxo-3H-purin-9-yl)butyl] 2-aminoacetate Traditional Name: 2-aminoacetic acid [4-(2-amino-6-keto-3H-purin-9-yl)-2-(glycyloxymethyl)butyl] ester Formula: C14H21N7O5 MolecularWeight: 367.36044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCC(COC(=O)CN)COC(=O)CN)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CCC(COC(=O)CN)COC(=O)CN)NC(=NC2=O)N

InChI

InChI=1S/C14H21N7O5/c15-3-9(22)25-5-8(6-26-10(23)4-16)1-2-21-7-18-11-12(21)19-14(17)20-13(11)24/h7-8H,1-6,15-16H2,(H3,17,19,20,24)