8-azanyl-2-(2-methoxy-5-phenylmethoxy-phenyl)purin-6-one

Systemtic Name: 8-azanyl-2-(2-methoxy-5-phenylmethoxy-phenyl)purin-6-one Openeye Name: 8-amino-2-(5-benzyloxy-2-methoxy-phenyl)purin-6-one CAS Name: 8-amino-2-(2-methoxy-5-phenylmethoxyphenyl)-6-purinone IUPAC Name: 8-amino-2-(2-methoxy-5-phenylmethoxyphenyl)purin-6-one Traditional Name: 8-amino-2-(5-benzoxy-2-methoxy-phenyl)purin-6-one Formula: C19H15N5O3 MolecularWeight: 361.3541

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OCC2=CC=CC=C2)C3=NC(=O)C4=NC(=NC4=N3)N

Isomeric SMILES

COC1=C(C=C(C=C1)OCC2=CC=CC=C2)C3=NC(=O)C4=NC(=NC4=N3)N

InChI

InChI=1S/C19H15N5O3/c1-26-14-8-7-12(27-10-11-5-3-2-4-6-11)9-13(14)16-22-17-15(18(25)23-16)21-19(20)24-17/h2-9H,10H2,1H3,(H2,20,22,23,24,25)