11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-octyl-undecanamide

Systemtic Name: 11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-octyl-undecanamide Openeye Name: 11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-octyl-undecanamide CAS Name: 11-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-octylundecanamide IUPAC Name: 11-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-octylundecanamide Traditional Name: 11-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-octyl-undecanamide Formula: C26H45N5O3 MolecularWeight: 475.6672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)CCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C

Isomeric SMILES

CCCCCCCCNC(=O)CCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C

InChI

InChI=1S/C26H45N5O3/c1-4-5-6-7-13-16-19-27-22(32)18-15-12-10-8-9-11-14-17-20-31-25(33)23-24(28-21-29(23)2)30(3)26(31)34/h21H,4-20H2,1-3H3,(H,27,32)