3-methyl-N-octadecyl-2,3,4-tris(oxidanyl)-N'-pyridin-2-yl-pentanediamide

Systemtic Name: 3-methyl-N-octadecyl-2,3,4-tris(oxidanyl)-N'-pyridin-2-yl-pentanediamide Openeye Name: 2,3,4-trihydroxy-3-methyl-N-octadecyl-N'-(2-pyridyl)pentanediamide CAS Name: 2,3,4-trihydroxy-3-methyl-N-octadecyl-N'-(2-pyridinyl)pentanediamide IUPAC Name: 2,3,4-trihydroxy-3-methyl-N-octadecyl-N'-pyridin-2-ylpentanediamide Traditional Name: 2,3,4-trihydroxy-3-methyl-N-(2-pyridyl)-N'-stearyl-glutaramide Formula: C29H51N3O5 MolecularWeight: 521.73234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(C(C)(C(C(=O)NC1=CC=CC=N1)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(C(C)(C(C(=O)NC1=CC=CC=N1)O)O)O

InChI

InChI=1S/C29H51N3O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-31-27(35)25(33)29(2,37)26(34)28(36)32-24-21-18-20-22-30-24/h18,20-22,25-26,33-34,37H,3-17,19,23H2,1-2H3,(H,31,35)(H,30,32,36)