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

Systemtic Name: N-decyl-N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-2-oxidanyl-undecyl]ethanamide Openeye Name: N-decyl-N-[11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-2-hydroxy-undecyl]acetamide CAS Name: N-decyl-N-[11-(3,7-dimethyl-2,6-dioxo-1-purinyl)-2-hydroxyundecyl]acetamide IUPAC Name: N-decyl-N-[11-(3,7-dimethyl-2,6-dioxopurin-1-yl)-2-hydroxyundecyl]acetamide Traditional Name: N-decyl-N-[11-(2,6-diketo-3,7-dimethyl-purin-1-yl)-2-hydroxy-undecyl]acetamide Formula: C30H53N5O4 MolecularWeight: 547.77292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(CC(CCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)O)C(=O)C

Isomeric SMILES

CCCCCCCCCCN(CC(CCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)O)C(=O)C

InChI

InChI=1S/C30H53N5O4/c1-5-6-7-8-9-12-15-18-21-34(25(2)36)23-26(37)20-17-14-11-10-13-16-19-22-35-29(38)27-28(31-24-32(27)3)33(4)30(35)39/h24,26,37H,5-23H2,1-4H3