3-[5-(6-chloranylpurin-9-yl)pentoxy]benzamide

Systemtic Name: 3-[5-(6-chloranylpurin-9-yl)pentoxy]benzamide Openeye Name: 3-[5-(6-chloropurin-9-yl)pentoxy]benzamide CAS Name: 3-[5-(6-chloro-9-purinyl)pentoxy]benzamide IUPAC Name: 3-[5-(6-chloropurin-9-yl)pentoxy]benzamide Traditional Name: 3-[5-(6-chloropurin-9-yl)pentoxy]benzamide Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCN2C=NC3=C2N=CN=C3Cl)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCN2C=NC3=C2N=CN=C3Cl)C(=O)N

InChI

InChI=1S/C17H18ClN5O2/c18-15-14-17(21-10-20-15)23(11-22-14)7-2-1-3-8-25-13-6-4-5-12(9-13)16(19)24/h4-6,9-11H,1-3,7-8H2,(H2,19,24)