(2S)-2-(6-aminopurin-9-yl)-4-(4-chloranylphenoxy)butan-1-ol

Systemtic Name: (2S)-2-(6-aminopurin-9-yl)-4-(4-chloranylphenoxy)butan-1-ol Openeye Name: (2S)-2-(6-aminopurin-9-yl)-4-(4-chlorophenoxy)butan-1-ol CAS Name: (2S)-2-(6-aminopurin-9-yl)-4-(4-chlorophenoxy)-1-butanol IUPAC Name: (2S)-2-(6-aminopurin-9-yl)-4-(4-chlorophenoxy)butan-1-ol Traditional Name: (2S)-2-adenin-9-yl-4-(4-chlorophenoxy)butan-1-ol Formula: C15H16ClN5O2 MolecularWeight: 333.77284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCC(CO)N2C=NC3=C2N=CN=C3N)Cl

Isomeric SMILES

C1=CC(=CC=C1OCC[C@@H](CO)N2C=NC3=C2N=CN=C3N)Cl

InChI

InChI=1S/C15H16ClN5O2/c16-10-1-3-12(4-2-10)23-6-5-11(7-22)21-9-20-13-14(17)18-8-19-15(13)21/h1-4,8-9,11,22H,5-7H2,(H2,17,18,19)/t11-/m0/s1