3-tert-butyl-9-methyl-1-prop-2-enyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione

Systemtic Name: 3-tert-butyl-9-methyl-1-prop-2-enyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione Openeye Name: 1-allyl-3-tert-butyl-9-methyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione CAS Name: 3-tert-butyl-9-methyl-1-prop-2-enyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione IUPAC Name: 3-tert-butyl-9-methyl-1-prop-2-enyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione Traditional Name: 1-allyl-3-tert-butyl-9-methyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-quinone Formula: C18H27N6O2+ MolecularWeight: 359.44598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(NC3=[N+]2CC(=NN3CC=C)C(C)(C)C)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(NC3=[N+]2CC(=NN3CC=C)C(C)(C)C)N(C1=O)C

InChI

InChI=1S/C18H26N6O2/c1-7-9-22-15(25)13-14(21(6)17(22)26)19-16-23(13)11-12(18(3,4)5)20-24(16)10-8-2/h8H,2,7,9-11H2,1,3-6H3/p+1