8-bromanyl-3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione

Systemtic Name: 8-bromanyl-3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione Openeye Name: 8-bromo-3-methyl-7-(1-naphthylmethyl)purine-2,6-dione CAS Name: 8-bromo-3-methyl-7-(1-naphthalenylmethyl)purine-2,6-dione IUPAC Name: 8-bromo-3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione Traditional Name: 8-bromo-3-methyl-7-(1-naphthylmethyl)xanthine Formula: C17H13BrN4O2 MolecularWeight: 385.21472

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C17H13BrN4O2/c1-21-14-13(15(23)20-17(21)24)22(16(18)19-14)9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8H,9H2,1H3,(H,20,23,24)