2-azanyl-9-[[3-(4-methoxyphenoxy)-3-oxidanyl-propoxy]methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[[3-(4-methoxyphenoxy)-3-oxidanyl-propoxy]methyl]-3H-purin-6-one Openeye Name: 2-amino-9-[[3-hydroxy-3-(4-methoxyphenoxy)propoxy]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[[3-hydroxy-3-(4-methoxyphenoxy)propoxy]methyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[[3-hydroxy-3-(4-methoxyphenoxy)propoxy]methyl]-3H-purin-6-one Traditional Name: 2-amino-9-[[3-hydroxy-3-(4-methoxyphenoxy)propoxy]methyl]-3H-purin-6-one Formula: C16H19N5O5 MolecularWeight: 361.35256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(CCOCN2C=NC3=C2NC(=NC3=O)N)O

Isomeric SMILES

COC1=CC=C(C=C1)OC(CCOCN2C=NC3=C2NC(=NC3=O)N)O

InChI

InChI=1S/C16H19N5O5/c1-24-10-2-4-11(5-3-10)26-12(22)6-7-25-9-21-8-18-13-14(21)19-16(17)20-15(13)23/h2-5,8,12,22H,6-7,9H2,1H3,(H3,17,19,20,23)