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

Systemtic Name: N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-2-oxidanyl-undecyl]-N-octyl-propanamide Openeye Name: N-[11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-2-hydroxy-undecyl]-N-octyl-propanamide CAS Name: N-[11-(3,7-dimethyl-2,6-dioxo-1-purinyl)-2-hydroxyundecyl]-N-octylpropanamide IUPAC Name: N-[11-(3,7-dimethyl-2,6-dioxopurin-1-yl)-2-hydroxyundecyl]-N-octylpropanamide Traditional Name: N-[11-(2,6-diketo-3,7-dimethyl-purin-1-yl)-2-hydroxy-undecyl]-N-octyl-propionamide Formula: C29H51N5O4 MolecularWeight: 533.74634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H51N5O4/c1-5-7-8-9-14-17-20-33(25(36)6-2)22-24(35)19-16-13-11-10-12-15-18-21-34-28(37)26-27(30-23-31(26)3)32(4)29(34)38/h23-24,35H,5-22H2,1-4H3