2-fluoranyl-2-methyl-5-(2-oxidanyl-4-phenyl-butyl)-N'-(pyridin-3-ylmethyl)hexanediamide

Systemtic Name: 2-fluoranyl-2-methyl-5-(2-oxidanyl-4-phenyl-butyl)-N'-(pyridin-3-ylmethyl)hexanediamide Openeye Name: 2-fluoro-5-(2-hydroxy-4-phenyl-butyl)-2-methyl-N'-(3-pyridylmethyl)hexanediamide CAS Name: 2-fluoro-5-(2-hydroxy-4-phenylbutyl)-2-methyl-N'-(3-pyridinylmethyl)hexanediamide IUPAC Name: 2-fluoro-5-(2-hydroxy-4-phenylbutyl)-2-methyl-N'-(pyridin-3-ylmethyl)hexanediamide Traditional Name: 2-fluoro-5-(2-hydroxy-4-phenyl-butyl)-2-methyl-N'-(3-pyridylmethyl)adipamide Formula: C23H30FN3O3 MolecularWeight: 415.501003

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC(CCC1=CC=CC=C1)O)C(=O)NCC2=CN=CC=C2)(C(=O)N)F

Isomeric SMILES

CC(CCC(CC(CCC1=CC=CC=C1)O)C(=O)NCC2=CN=CC=C2)(C(=O)N)F

InChI

InChI=1S/C23H30FN3O3/c1-23(24,22(25)30)12-11-19(21(29)27-16-18-8-5-13-26-15-18)14-20(28)10-9-17-6-3-2-4-7-17/h2-8,13,15,19-20,28H,9-12,14,16H2,1H3,(H2,25,30)(H,27,29)