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

Systemtic Name: 8-(phenylmethyl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-benzyl-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-(phenylmethyl)-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-benzyl-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-benzyl-1,3-dipropyl-7H-purine-2,6-quinone Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)CC3=CC=CC=C3

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O2/c1-3-10-21-16-15(17(23)22(11-4-2)18(21)24)19-14(20-16)12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3,(H,19,20)