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

Systemtic Name: 3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione Openeye Name: 3-methyl-7-(1-naphthylmethyl)purine-2,6-dione CAS Name: 3-methyl-7-(1-naphthalenylmethyl)purine-2,6-dione IUPAC Name: 3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione Traditional Name: 3-methyl-7-(1-naphthylmethyl)xanthine Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O2/c1-20-15-14(16(22)19-17(20)23)21(10-18-15)9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8,10H,9H2,1H3,(H,19,22,23)