8-(4-iodophenyl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(4-iodophenyl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(4-iodophenyl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-(4-iodophenyl)-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(4-iodophenyl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(4-iodophenyl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C17H19IN4O2 MolecularWeight: 438.26283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19IN4O2/c1-3-9-21-15-13(16(23)22(10-4-2)17(21)24)19-14(20-15)11-5-7-12(18)8-6-11/h5-8H,3-4,9-10H2,1-2H3,(H,19,20)