2-[3,5-bis(oxidanyl)phenyl]-7-(phenylmethyl)-3H-purin-6-one

Systemtic Name: 2-[3,5-bis(oxidanyl)phenyl]-7-(phenylmethyl)-3H-purin-6-one Openeye Name: 7-benzyl-2-(3,5-dihydroxyphenyl)-3H-purin-6-one CAS Name: 2-(3,5-dihydroxyphenyl)-7-(phenylmethyl)-3H-purin-6-one IUPAC Name: 7-benzyl-2-(3,5-dihydroxyphenyl)-3H-purin-6-one Traditional Name: 7-benzyl-2-(3,5-dihydroxyphenyl)-3H-purin-6-one Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC(=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC(=C4)O)O

InChI

InChI=1S/C18H14N4O3/c23-13-6-12(7-14(24)8-13)16-20-17-15(18(25)21-16)22(10-19-17)9-11-4-2-1-3-5-11/h1-8,10,23-24H,9H2,(H,20,21,25)