[3-(6-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl octyl hydrogen phosphate

Systemtic Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl octyl hydrogen phosphate Openeye Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl octyl hydrogen phosphate CAS Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl octyl hydrogen phosphate IUPAC Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl octyl hydrogen phosphate Traditional Name: (3-adenin-9-yl-2-methylol-cyclobutyl)methyl octyl hydrogen phosphate Formula: C19H32N5O5P MolecularWeight: 441.461641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(O)OCC1CC(C1CO)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CCCCCCCCOP(=O)(O)OCC1CC(C1CO)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C19H32N5O5P/c1-2-3-4-5-6-7-8-28-30(26,27)29-11-14-9-16(15(14)10-25)24-13-23-17-18(20)21-12-22-19(17)24/h12-16,25H,2-11H2,1H3,(H,26,27)(H2,20,21,22)