2-azanyl-9-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-7,8-dihydro-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-7,8-dihydro-3H-purin-6-one Openeye Name: 2-amino-9-[[2-benzyloxy-1-(benzyloxymethyl)ethoxy]methyl]-7,8-dihydro-3H-purin-6-one CAS Name: 2-amino-9-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-7,8-dihydro-3H-purin-6-one IUPAC Name: 2-amino-9-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-7,8-dihydro-3H-purin-6-one Traditional Name: 2-amino-9-[[2-benzoxy-1-(benzoxymethyl)ethoxy]methyl]-7,8-dihydro-3H-purin-6-one Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1COC(COCC3=CC=CC=C3)COCC4=CC=CC=C4)NC(=NC2=O)N

Isomeric SMILES

C1NC2=C(N1COC(COCC3=CC=CC=C3)COCC4=CC=CC=C4)NC(=NC2=O)N

InChI

InChI=1S/C23H27N5O4/c24-23-26-21-20(22(29)27-23)25-15-28(21)16-32-19(13-30-11-17-7-3-1-4-8-17)14-31-12-18-9-5-2-6-10-18/h1-10,19,25H,11-16H2,(H3,24,26,27,29)