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

Systemtic Name: 2-azanyl-7-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-3H-purin-6-one Openeye Name: 2-amino-7-[[2-benzyloxy-1-(benzyloxymethyl)ethoxy]methyl]-3H-purin-6-one CAS Name: 2-amino-7-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-7-[1,3-bis(phenylmethoxy)propan-2-yloxymethyl]-3H-purin-6-one Traditional Name: 2-amino-7-[[2-benzoxy-1-(benzoxymethyl)ethoxy]methyl]-3H-purin-6-one Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(COCC2=CC=CC=C2)OCN3C=NC4=C3C(=O)N=C(N4)N

Isomeric SMILES

C1=CC=C(C=C1)COCC(COCC2=CC=CC=C2)OCN3C=NC4=C3C(=O)N=C(N4)N

InChI

InChI=1S/C23H25N5O4/c24-23-26-21-20(22(29)27-23)28(15-25-21)16-32-19(13-30-11-17-7-3-1-4-8-17)14-31-12-18-9-5-2-6-10-18/h1-10,15,19H,11-14,16H2,(H3,24,26,27,29)