3-[12-(6-chloranylpurin-9-yl)dodecoxy]benzamide

Systemtic Name: 3-[12-(6-chloranylpurin-9-yl)dodecoxy]benzamide Openeye Name: 3-[12-(6-chloropurin-9-yl)dodecoxy]benzamide CAS Name: 3-[12-(6-chloro-9-purinyl)dodecoxy]benzamide IUPAC Name: 3-[12-(6-chloropurin-9-yl)dodecoxy]benzamide Traditional Name: 3-[12-(6-chloropurin-9-yl)dodecoxy]benzamide Formula: C24H32ClN5O2 MolecularWeight: 457.99618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCCCCCCCCN2C=NC3=C2N=CN=C3Cl)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCCCCCCCCN2C=NC3=C2N=CN=C3Cl)C(=O)N

InChI

InChI=1S/C24H32ClN5O2/c25-22-21-24(28-17-27-22)30(18-29-21)14-9-7-5-3-1-2-4-6-8-10-15-32-20-13-11-12-19(16-20)23(26)31/h11-13,16-18H,1-10,14-15H2,(H2,26,31)