3-(3-methoxypropyl)-1-pentyl-8-phenyl-7H-purine-2,6-dione

Systemtic Name: 3-(3-methoxypropyl)-1-pentyl-8-phenyl-7H-purine-2,6-dione Openeye Name: 3-(3-methoxypropyl)-1-pentyl-8-phenyl-7H-purine-2,6-dione CAS Name: 3-(3-methoxypropyl)-1-pentyl-8-phenyl-7H-purine-2,6-dione IUPAC Name: 3-(3-methoxypropyl)-1-pentyl-8-phenyl-7H-purine-2,6-dione Traditional Name: 1-amyl-3-(3-methoxypropyl)-8-phenyl-7H-purine-2,6-quinone Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(N=C(N2)C3=CC=CC=C3)N(C1=O)CCCOC

Isomeric SMILES

CCCCCN1C(=O)C2=C(N=C(N2)C3=CC=CC=C3)N(C1=O)CCCOC

InChI

InChI=1S/C20H26N4O3/c1-3-4-8-12-24-19(25)16-18(23(20(24)26)13-9-14-27-2)22-17(21-16)15-10-6-5-7-11-15/h5-7,10-11H,3-4,8-9,12-14H2,1-2H3,(H,21,22)