2-[4-[2,6-bis(oxidanylidene)-1-propyl-3,7-dihydropurin-8-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2,6-bis(oxidanylidene)-1-propyl-3,7-dihydropurin-8-yl]phenoxy]ethanoic acid Openeye Name: 2-[4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)phenoxy]acetic acid CAS Name: 2-[4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)phenoxy]acetic acid IUPAC Name: 2-[4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)phenoxy]acetic acid Traditional Name: 2-[4-(2,6-diketo-1-propyl-3,7-dihydropurin-8-yl)phenoxy]acetic acid Formula: C16H16N4O5 MolecularWeight: 344.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)OCC(=O)O

Isomeric SMILES

CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)OCC(=O)O

InChI

InChI=1S/C16H16N4O5/c1-2-7-20-15(23)12-14(19-16(20)24)18-13(17-12)9-3-5-10(6-4-9)25-8-11(21)22/h3-6H,2,7-8H2,1H3,(H,17,18)(H,19,24)(H,21,22)