N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-2-oxidanyl-undecyl]octanamide

Systemtic Name: N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-2-oxidanyl-undecyl]octanamide Openeye Name: N-[11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-2-hydroxy-undecyl]octanamide CAS Name: N-[11-(3,7-dimethyl-2,6-dioxo-1-purinyl)-2-hydroxyundecyl]octanamide IUPAC Name: N-[11-(3,7-dimethyl-2,6-dioxopurin-1-yl)-2-hydroxyundecyl]octanamide Traditional Name: N-[11-(2,6-diketo-3,7-dimethyl-purin-1-yl)-2-hydroxy-undecyl]caprylamide Formula: C26H45N5O4 MolecularWeight: 491.6666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCC(CCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)O

Isomeric SMILES

CCCCCCCC(=O)NCC(CCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)O

InChI

InChI=1S/C26H45N5O4/c1-4-5-6-10-14-17-22(33)27-19-21(32)16-13-11-8-7-9-12-15-18-31-25(34)23-24(28-20-29(23)2)30(3)26(31)35/h20-21,32H,4-19H2,1-3H3,(H,27,33)