N1,N3-bis[6-(decanoylamino)pyridin-2-yl]-5-decoxy-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[6-(decanoylamino)pyridin-2-yl]-5-decoxy-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[6-(decanoylamino)-2-pyridyl]-5-decoxy-benzene-1,3-dicarboxamide CAS Name: 5-decoxy-N1,N3-bis[6-(1-oxodecylamino)-2-pyridinyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[6-(decanoylamino)pyridin-2-yl]-5-decoxybenzene-1,3-dicarboxamide Traditional Name: N,N'-bis[6-(caprylamino)-2-pyridyl]-5-decoxy-isophthalamide Formula: C48H72N6O5 MolecularWeight: 813.12248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=CC(=C1)C(=O)NC2=NC(=CC=C2)NC(=O)CCCCCCCCC)C(=O)NC3=NC(=CC=C3)NC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC(=CC(=C1)C(=O)NC2=NC(=CC=C2)NC(=O)CCCCCCCCC)C(=O)NC3=NC(=CC=C3)NC(=O)CCCCCCCCC

InChI

InChI=1S/C48H72N6O5/c1-4-7-10-13-16-19-22-25-34-59-40-36-38(47(57)53-43-30-26-28-41(49-43)51-45(55)32-23-20-17-14-11-8-5-2)35-39(37-40)48(58)54-44-31-27-29-42(50-44)52-46(56)33-24-21-18-15-12-9-6-3/h26-31,35-37H,4-25,32-34H2,1-3H3,(H2,49,51,53,55,57)(H2,50,52,54,56,58)