10-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]decan-5-olate

Systemtic Name: 10-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]decan-5-olate Openeye Name: 10-(3,7-dimethyl-2,6-dioxo-purin-1-yl)decan-5-olate CAS Name: 10-(3,7-dimethyl-2,6-dioxo-1-purinyl)-5-decanolate IUPAC Name: 10-(3,7-dimethyl-2,6-dioxopurin-1-yl)decan-5-olate Traditional Name: 10-(2,6-diketo-3,7-dimethyl-purin-1-yl)decan-5-olate Formula: C17H27N4O3- MolecularWeight: 335.42128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)[O-]

Isomeric SMILES

CCCCC(CCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)[O-]

InChI

InChI=1S/C17H27N4O3/c1-4-5-9-13(22)10-7-6-8-11-21-16(23)14-15(18-12-19(14)2)20(3)17(21)24/h12-13H,4-11H2,1-3H3/q-1