8-azanyl-2-(2-phenylmethoxyphenyl)purin-6-one

Systemtic Name: 8-azanyl-2-(2-phenylmethoxyphenyl)purin-6-one Openeye Name: 8-amino-2-(2-benzyloxyphenyl)purin-6-one CAS Name: 8-amino-2-(2-phenylmethoxyphenyl)-6-purinone IUPAC Name: 8-amino-2-(2-phenylmethoxyphenyl)purin-6-one Traditional Name: 8-amino-2-(2-benzoxyphenyl)purin-6-one Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C3=NC(=O)C4=NC(=NC4=N3)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C3=NC(=O)C4=NC(=NC4=N3)N

InChI

InChI=1S/C18H13N5O2/c19-18-20-14-16(23-18)21-15(22-17(14)24)12-8-4-5-9-13(12)25-10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,19,21,22,23,24)