2-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]cyclopentene-1-carboxylic acid

Systemtic Name: 2-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]cyclopentene-1-carboxylic acid Openeye Name: 2-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)cyclopentene-1-carboxylic acid CAS Name: 2-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-1-cyclopentenecarboxylic acid IUPAC Name: 2-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)cyclopentene-1-carboxylic acid Traditional Name: 2-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)cyclopentene-1-carboxylic acid Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=C(CCC3)C(=O)O

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=C(CCC3)C(=O)O

InChI

InChI=1S/C17H22N4O4/c1-3-8-20-14-12(15(22)21(9-4-2)17(20)25)18-13(19-14)10-6-5-7-11(10)16(23)24/h3-9H2,1-2H3,(H,18,19)(H,23,24)