8-(2-methyl-3-oxidanylidene-5-prop-1-en-2-yl-cyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(2-methyl-3-oxidanylidene-5-prop-1-en-2-yl-cyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(5-isopropenyl-2-methyl-3-oxo-cyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[2-methyl-5-(1-methylethenyl)-3-oxocyclopentyl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(2-methyl-3-oxo-5-prop-1-en-2-ylcyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(5-isopropenyl-3-keto-2-methyl-cyclopentyl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3C(C(=O)CC3C(=C)C)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3C(C(=O)CC3C(=C)C)C

InChI

InChI=1S/C20H28N4O3/c1-6-8-23-18-16(19(26)24(9-7-2)20(23)27)21-17(22-18)15-12(5)14(25)10-13(15)11(3)4/h12-13,15H,3,6-10H2,1-2,4-5H3,(H,21,22)