2-ethyl-7-[(4-hydroxyphenyl)methyl]-3H-purin-6-one

Systemtic Name: 2-ethyl-7-[(4-hydroxyphenyl)methyl]-3H-purin-6-one Openeye Name: 2-ethyl-7-[(4-hydroxyphenyl)methyl]-3H-purin-6-one CAS Name: 2-ethyl-7-[(4-hydroxyphenyl)methyl]-3H-purin-6-one IUPAC Name: 2-ethyl-7-[(4-hydroxyphenyl)methyl]-3H-purin-6-one Traditional Name: 2-ethyl-7-(4-hydroxybenzyl)-3H-purin-6-one Formula: C14H14N4O2 MolecularWeight: 270.28656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=O)C2=C(N1)N=CN2CC3=CC=C(C=C3)O

Isomeric SMILES

CCC1=NC(=O)C2=C(N1)N=CN2CC3=CC=C(C=C3)O

InChI

InChI=1S/C14H14N4O2/c1-2-11-16-13-12(14(20)17-11)18(8-15-13)7-9-3-5-10(19)6-4-9/h3-6,8,19H,2,7H2,1H3,(H,16,17,20)