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

Systemtic Name: N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]undecyl]-N-octyl-ethanamide Openeye Name: N-[11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)undecyl]-N-octyl-acetamide CAS Name: N-[11-(3,7-dimethyl-2,6-dioxo-1-purinyl)undecyl]-N-octylacetamide IUPAC Name: N-[11-(3,7-dimethyl-2,6-dioxopurin-1-yl)undecyl]-N-octylacetamide Traditional Name: N-[11-(2,6-diketo-3,7-dimethyl-purin-1-yl)undecyl]-N-octyl-acetamide Formula: C28H49N5O3 MolecularWeight: 503.72036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)C(=O)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)C(=O)C

InChI

InChI=1S/C28H49N5O3/c1-5-6-7-8-14-17-20-32(24(2)34)21-18-15-12-10-9-11-13-16-19-22-33-27(35)25-26(29-23-30(25)3)31(4)28(33)36/h23H,5-22H2,1-4H3