2-azanyl-9-[4-oxidanyl-2-(phenylmethoxymethyl)butyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-oxidanyl-2-(phenylmethoxymethyl)butyl]-3H-purin-6-one Openeye Name: 2-amino-9-[2-(benzyloxymethyl)-4-hydroxy-butyl]-3H-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-2-(phenylmethoxymethyl)butyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-hydroxy-2-(phenylmethoxymethyl)butyl]-3H-purin-6-one Traditional Name: 2-amino-9-[2-(benzoxymethyl)-4-hydroxy-butyl]-3H-purin-6-one Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CCO)CN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

C1=CC=C(C=C1)COCC(CCO)CN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C17H21N5O3/c18-17-20-15-14(16(24)21-17)19-11-22(15)8-13(6-7-23)10-25-9-12-4-2-1-3-5-12/h1-5,11,13,23H,6-10H2,(H3,18,20,21,24)