N-(1,3-benzodioxol-5-yl)-2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(3,7-dimethyl-2,6-dioxo-1-purinyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(3,7-dimethyl-2,6-dioxopurin-1-yl)acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(2,6-diketo-3,7-dimethyl-purin-1-yl)acetamide Formula: C16H15N5O5 MolecularWeight: 357.3208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H15N5O5/c1-19-7-17-14-13(19)15(23)21(16(24)20(14)2)6-12(22)18-9-3-4-10-11(5-9)26-8-25-10/h3-5,7H,6,8H2,1-2H3,(H,18,22)