8-(2-azanylethylamino)-3-methyl-7-nonyl-purine-2,6-dione

Systemtic Name: 8-(2-azanylethylamino)-3-methyl-7-nonyl-purine-2,6-dione Openeye Name: 8-(2-aminoethylamino)-3-methyl-7-nonyl-purine-2,6-dione CAS Name: 8-(2-aminoethylamino)-3-methyl-7-nonylpurine-2,6-dione IUPAC Name: 8-(2-aminoethylamino)-3-methyl-7-nonylpurine-2,6-dione Traditional Name: 8-(2-aminoethylamino)-3-methyl-7-nonyl-xanthine Formula: C17H30N6O2 MolecularWeight: 350.4591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C2=C(N=C1NCCN)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCN1C2=C(N=C1NCCN)N(C(=O)NC2=O)C

InChI

InChI=1S/C17H30N6O2/c1-3-4-5-6-7-8-9-12-23-13-14(20-16(23)19-11-10-18)22(2)17(25)21-15(13)24/h3-12,18H2,1-2H3,(H,19,20)(H,21,24,25)