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9-(1-oxidanylhexan-2-yl)-2-(2-propoxyphenyl)-3H-purin-6-one

9-(1-oxidanylhexan-2-yl)-2-(2-propoxyphenyl)-3H-purin-6-one

Systemtic Name:9-(1-oxidanylhexan-2-yl)-2-(2-propoxyphenyl)-3H-purin-6-one
Openeye Name:9-[1-(hydroxymethyl)pentyl]-2-(2-propoxyphenyl)-3H-purin-6-one
CAS Name:9-(1-hydroxyhexan-2-yl)-2-(2-propoxyphenyl)-3H-purin-6-one
IUPAC Name:9-(1-hydroxyhexan-2-yl)-2-(2-propoxyphenyl)-3H-purin-6-one
Traditional Name:9-(1-methylolpentyl)-2-(2-propoxyphenyl)-3H-purin-6-one
Formula: C20H26N4O3
MolecularWeight: 370.44544
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CO)N1C=NC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC


Isomeric SMILES

CCCCC(CO)N1C=NC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC


InChI

InChI=1S/C20H26N4O3/c1-3-5-8-14(12-25)24-13-21-17-19(24)22-18(23-20(17)26)15-9-6-7-10-16(15)27-11-4-2/h6-7,9-10,13-14,25H,3-5,8,11-12H2,1-2H3,(H,22,23,26)


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