2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-7-(naphthalen-2-ylmethyl)purin-6-one

Systemtic Name: 2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-7-(naphthalen-2-ylmethyl)purin-6-one Openeye Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-7-(2-naphthylmethyl)purin-6-one CAS Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-7-(2-naphthalenylmethyl)-6-purinone IUPAC Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-7-(naphthalen-2-ylmethyl)purin-6-one Traditional Name: 2-amino-7-(2-naphthylmethyl)-1-piperonyl-purin-6-one Formula: C24H19N5O3 MolecularWeight: 425.43936

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(N=CN4CC5=CC6=CC=CC=C6C=C5)N=C3N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(N=CN4CC5=CC6=CC=CC=C6C=C5)N=C3N

InChI

InChI=1S/C24H19N5O3/c25-24-27-22-21(23(30)29(24)12-16-6-8-19-20(10-16)32-14-31-19)28(13-26-22)11-15-5-7-17-3-1-2-4-18(17)9-15/h1-10,13H,11-12,14H2,(H2,25,27)