2-azanyl-9-[5-(hydroxymethyl)-3-nonoxy-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(hydroxymethyl)-3-nonoxy-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-3-nonoxy-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-3-nonoxy-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-3-nonoxyoxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-(4-hydroxy-5-methylol-3-nonoxy-tetrahydrofuran-2-yl)-3H-purin-6-one Formula: C19H31N5O5 MolecularWeight: 409.47994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)O

Isomeric SMILES

CCCCCCCCCOC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)O

InChI

InChI=1S/C19H31N5O5/c1-2-3-4-5-6-7-8-9-28-15-14(26)12(10-25)29-18(15)24-11-21-13-16(24)22-19(20)23-17(13)27/h11-12,14-15,18,25-26H,2-10H2,1H3,(H3,20,22,23,27)