2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanal; guanidine

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanal; guanidine Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetaldehyde; guanidine CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetaldehyde; guanidine IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetaldehyde; guanidine Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetaldehyde; guanidine Formula: C10H15N7O3 MolecularWeight: 281.2712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC=O.C(=N)(N)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC=O.C(=N)(N)N

InChI

InChI=1S/C9H10N4O3.CH5N3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7;2-1(3)4/h4-5H,3H2,1-2H3;(H5,2,3,4)