(2R,3S)-3-(6-chloranyl-2-phenyl-purin-9-yl)heptan-2-ol

Systemtic Name: (2R,3S)-3-(6-chloranyl-2-phenyl-purin-9-yl)heptan-2-ol Openeye Name: (2R,3S)-3-(6-chloro-2-phenyl-purin-9-yl)heptan-2-ol CAS Name: (2R,3S)-3-(6-chloro-2-phenyl-9-purinyl)-2-heptanol IUPAC Name: (2R,3S)-3-(6-chloro-2-phenylpurin-9-yl)heptan-2-ol Traditional Name: (2R,3S)-3-(6-chloro-2-phenyl-purin-9-yl)heptan-2-ol Formula: C18H21ClN4O MolecularWeight: 344.83854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)O)N1C=NC2=C1N=C(N=C2Cl)C3=CC=CC=C3

Isomeric SMILES

CCCC[C@@H]([C@@H](C)O)N1C=NC2=C1N=C(N=C2Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H21ClN4O/c1-3-4-10-14(12(2)24)23-11-20-15-16(19)21-17(22-18(15)23)13-8-6-5-7-9-13/h5-9,11-12,14,24H,3-4,10H2,1-2H3/t12-,14+/m1/s1