8-[2,2-bis(azanyl)-1-(8-oxidanyl-8-oxidanylidene-octyl)cyclohexyl]octanoic acid

Systemtic Name: 8-[2,2-bis(azanyl)-1-(8-oxidanyl-8-oxidanylidene-octyl)cyclohexyl]octanoic acid Openeye Name: 8-[2,2-diamino-1-(8-hydroxy-8-oxo-octyl)cyclohexyl]octanoic acid CAS Name: 8-[2,2-diamino-1-(8-hydroxy-8-oxooctyl)cyclohexyl]octanoic acid IUPAC Name: 8-[2,2-diamino-1-(8-hydroxy-8-oxooctyl)cyclohexyl]octanoic acid Traditional Name: 8-[2,2-diamino-1-(8-hydroxy-8-keto-octyl)cyclohexyl]caprylic acid Formula: C22H42N2O4 MolecularWeight: 398.57988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)(CCCCCCCC(=O)O)CCCCCCCC(=O)O)(N)N

Isomeric SMILES

C1CCC(C(C1)(CCCCCCCC(=O)O)CCCCCCCC(=O)O)(N)N

InChI

InChI=1S/C22H42N2O4/c23-22(24)18-12-11-17-21(22,15-9-5-1-3-7-13-19(25)26)16-10-6-2-4-8-14-20(27)28/h1-18,23-24H2,(H,25,26)(H,27,28)