methyl 2-[(8-ethoxy-9-methyl-purin-6-yl)-methyl-amino]ethanoate

Systemtic Name: methyl 2-[(8-ethoxy-9-methyl-purin-6-yl)-methyl-amino]ethanoate Openeye Name: methyl 2-[(8-ethoxy-9-methyl-purin-6-yl)-methyl-amino]acetate CAS Name: 2-[(8-ethoxy-9-methyl-6-purinyl)-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(8-ethoxy-9-methylpurin-6-yl)-methylamino]acetate Traditional Name: 2-[(8-ethoxy-9-methyl-purin-6-yl)-methyl-amino]acetic acid methyl ester Formula: C12H17N5O3 MolecularWeight: 279.29508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(N1C)N=CN=C2N(C)CC(=O)OC

Isomeric SMILES

CCOC1=NC2=C(N1C)N=CN=C2N(C)CC(=O)OC

InChI

InChI=1S/C12H17N5O3/c1-5-20-12-15-9-10(16(2)6-8(18)19-4)13-7-14-11(9)17(12)3/h7H,5-6H2,1-4H3