2-azanyl-9-octyl-7-prop-2-enyl-3H-purine-6,8-dione

Systemtic Name: 2-azanyl-9-octyl-7-prop-2-enyl-3H-purine-6,8-dione Openeye Name: 7-allyl-2-amino-9-octyl-3H-purine-6,8-dione CAS Name: 2-amino-9-octyl-7-prop-2-enyl-3H-purine-6,8-dione IUPAC Name: 2-amino-9-octyl-7-prop-2-enyl-3H-purine-6,8-dione Traditional Name: 7-allyl-2-amino-9-octyl-3H-purine-6,8-quinone Formula: C16H25N5O2 MolecularWeight: 319.402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C(=O)N=C(N2)N)N(C1=O)CC=C

Isomeric SMILES

CCCCCCCCN1C2=C(C(=O)N=C(N2)N)N(C1=O)CC=C

InChI

InChI=1S/C16H25N5O2/c1-3-5-6-7-8-9-11-21-13-12(14(22)19-15(17)18-13)20(10-4-2)16(21)23/h4H,2-3,5-11H2,1H3,(H3,17,18,19,22)